3-amino-5-(methylcarbamoyl)benzoic acid
Structure Info
- Chemspace ID
- CSSB00000075461 (In-Stock Building Blocks)
- CAS
- 1954-96-7
- MFCD
- MFCD00215980, MFCD00215980
- IUPAC Name
- 3-amino-5-(methylcarbamoyl)benzoic acid
- Mol formula
- C9H10N2O3
- Mol weight
- 194 Da
- Catalog Number(s)
- 1954-96-7, A019092750, ACM1954967, AD08521, AG00748K, AG212973, AKOS006272749, AR0074XK, BBLS00000075461, BBV-38276501, BD11231, CD12100071, CSC000075461, EN300-1672775, FA166367, FCH840454, SC-17482, ST0075PC, Y3601537, Z2688, bbls00000075461
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.12
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.11111111111111
- Polar surface area (Å)
- 92
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSSB00000075461
Items Overall 32 items from 7 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 100.89 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 134.24 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 187.78 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 228.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 304.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 205.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 306.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 438.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 691.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 884.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 50 mg | 205.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 100 mg | 306.00 | |
| Enamine LV SIA | 5 days | Latvia To: | 95 | 250 mg | 438.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 205.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 306.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 438.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 691.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 100.89 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 134.24 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 187.78 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 228.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 304.00 | |
| 1st Scientific CN | 7 days | China To: | 95 | 50 mg | 290.40 | |
| 1st Scientific CN | 7 days | China To: | 95 | 100 mg | 408.10 | |
| 1st Scientific CN | 7 days | China To: | 95 | 250 mg | 561.00 | |
| 1st Scientific CN | 7 days | China To: | 95 | 500 mg | 853.60 | |
| 1st Scientific CN | 7 days | China To: | 95 | 1 g | 1,076.90 | |
Description: 3-Amino-5-(methylcarbamoyl)benzoic acid; CAS: 1954-96-7 | ||||||
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 290.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 408.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 561.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 853.60 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 1,076.90 | |
Description: 3-Amino-5-(methylcarbamoyl)benzoic acid; CAS: 1954-96-7 | ||||||
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Substructure Analogs
![Chemical structure of 3-amino-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid - CSSB00015237445](/st/structure/200/53213a1a9abe60d237e47cad98b45128/NC1%253DC%2528I%2529C%2528C%2528O%2529%253DO%2529%253DC%2528I%2529C%2528C%2528%253DO%2529NCCO%2529%253DC1I.png)
![Chemical structure of 3-acetamido-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid - CSSB00016995272](/st/structure/200/2679dd6fcb3f5f484225ddf0267d5daf/CC%2528%253DO%2529NC1%253DC%2528I%2529C%2528C%2528O%2529%253DO%2529%253DC%2528I%2529C%2528C%2528%253DO%2529NCCO%2529%253DC1I.png)
![Chemical structure of methyl 3-[(2,4-dichlorophenyl)carbamoyl]-5-nitrobenzoate - CSSB00046261845](/st/structure/200/9a37b30e394d1f04ce2b6215bef54af0/COC%2528%253DO%2529C1%253DCC%2528%253DCC%2528%253DC1%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529C%2528%253DO%2529NC1%253DCC%253DC%2528Cl%2529C%253DC1Cl.png)
Similarity Analogs
![Chemical structure of 5-amino-4'-(methylcarbamoyl)-[1,1'-biphenyl]-3-carboxylic acid - CSSB06593732724](/st/structure/200/257a7e98e37b2676c5058ab7ce88f198/CNC%2528%253DO%2529C1%253DCC%253DC%2528C2%253DCC%2528N%2529%253DCC%2528C%2528%253DO%2529O%2529%253DC2%2529C%253DC1.png)
![Chemical structure of 3-amino-5-[5-(methylcarbamoyl)pyridin-3-yl]benzoic acid - CSSB06593737205](/st/structure/200/4f5c6c3ce43eb4f9fc6d5ab9aa6b6e6c/CNC%2528%253DO%2529C1%253DCN%253DCC%2528C2%253DCC%2528N%2529%253DCC%2528C%2528%253DO%2529O%2529%253DC2%2529%253DC1.png)
![Chemical structure of 5-amino-3'-(methylcarbamoyl)-[1,1'-biphenyl]-3-carboxylic acid - CSSB00150700938](/st/structure/200/20238be053237364e6af55b39500d015/CNC%2528%253DO%2529C1%253DCC%253DCC%2528%253DC1%2529C1%253DCC%2528N%2529%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
