3-({[(4-chlorophenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid
Structure Info
- Chemspace ID
- CSSB00102605701 (In-Stock Building Blocks)
- MFCD
- MFCD03246112
- IUPAC Name
- 3-({[(4-chlorophenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid
- Mol formula
- C16H13ClN2O3S
- Mol weight
- 349 Da
- Catalog Number(s)
- 6976075, AA00DQ6O, AG40364, CSC102605701, OSSL_832238, TX00DRF4
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.39
- Heavy atoms count
- 23
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.062
- Polar surface area (Å)
- 78
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 3
![Chemical structure of 3-({[(4-chlorophenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid (C16H13ClN2O3S) - CSSB00102605701](/st/structure/200/9b8389574d7a39282c78551e21722f3a/CC1%253DCC%253DC%2528C%253DC1NC%2528%253DS%2529NC%2528%253DO%2529C1%253DCC%253DC%2528Cl%2529C%253DC1%2529C%2528O%2529%253DO.png "C16H13ClN2O3S")
- Zoom the structure
- CSSB00102605701
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| AA Blocks CN | 12 days | China To: | 90 | 5 mg | 150.70 | |
Description: 3-[[[(4-CHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-4-METHYL-BENZOIC ACID; CAS: 433698-94-3 | ||||||
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Substructure Analogs
![Chemical structure of 3-({[(2,4-dichlorophenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid - CSSB00102605630](/st/structure/200/b6f01cf460d0e5582fe7aabd535a437a/CC1%253DCC%253DC%2528C%253DC1NC%2528%253DS%2529NC%2528%253DO%2529C1%253DCC%253DC%2528Cl%2529C%253DC1Cl%2529C%2528O%2529%253DO.png)
Similarity Analogs
![Chemical structure of 3-({[(3-chloro-4-methylphenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid - CSSB00102605683](/st/structure/200/5efa7a3c344206b94001a164fbb4020d/CC1%253DCC%253DC%2528C%253DC1Cl%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC%2528%253DCC%253DC1C%2529C%2528O%2529%253DO.png)
![Chemical structure of 5-chloro-2-({[(3,4-dimethylphenyl)formamido]methanethioyl}amino)benzoic acid - CSSB00102616349](/st/structure/200/6b6fd52a1d3f092d73fb8400e1701131/CC1%253DCC%253DC%2528C%253DC1C%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC%253DC%2528Cl%2529C%253DC1C%2528O%2529%253DO.png)
![Chemical structure of 3-({[(4-methoxyphenyl)formamido]methanethioyl}amino)-4-methylbenzoic acid - CSSB00102605710](/st/structure/200/aaa2c8db72b65d8aee68aa8020bc9a15/COC1%253DCC%253DC%2528C%253DC1%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC%2528%253DCC%253DC1C%2529C%2528O%2529%253DO.png)
![Chemical structure of 4-chloro-3-({[(2-methylphenyl)formamido]methanethioyl}amino)benzoic acid - CSSB00102610441](/st/structure/200/1e3f484c07bae144ff15d703785ca98e/CC1%253DCC%253DCC%253DC1C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC%2528%253DCC%253DC1Cl%2529C%2528O%2529%253DO.png)
![Chemical structure of 3-({[(3-chloro-4-methylphenyl)formamido]methanethioyl}amino)benzoic acid - CSSB00102605684](/st/structure/200/358ef0df0a5c696802670fc82dee3c14/CC1%253DCC%253DC%2528C%253DC1Cl%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
![Chemical structure of 4-chloro-3-({[(2,4-dichlorophenyl)formamido]methanethioyl}amino)benzoic acid - CSSB00102610430](/st/structure/200/ae0303961785780cea481f32aababbe0/OC%2528%253DO%2529C1%253DCC%253DC%2528Cl%2529C%2528NC%2528%253DS%2529NC%2528%253DO%2529C2%253DCC%253DC%2528Cl%2529C%253DC2Cl%2529%253DC1.png)
