1-(3,4-dimethoxybenzoyl)-3-(2-phenyl-2H-1,2,3-benzotriazol-5-yl)thiourea
Structure Info
- Chemspace ID
- CSSB00121706529 (In-Stock Building Blocks)
- MFCD
- MFCD02577934
- IUPAC Name
- 1-(3,4-dimethoxybenzoyl)-3-(2-phenyl-2H-1,2,3-benzotriazol-5-yl)thiourea
- Mol formula
- C22H19N5O3S
- Mol weight
- 433 Da
- Catalog Number(s)
- AA02YS20, AG-690/15429902, BX81796, CSC121706529, OSSK_332360, ST02YTLK, STK029042, STOCK3S-83050, TX02YTAG
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.01
- Heavy atoms count
- 31
- Rotatable bond count
- 5
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.09
- Polar surface area (Å)
- 90
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSB00121706529
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
Description: 3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide; CAS: 335213-58-6 | ||||||
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Substructure Analogs
![Chemical structure of 1-(3,4-dimethoxybenzoyl)-3-[2-(4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea - CSSB00121706528](/st/structure/200/447569b540fc1fe85b2a17d6d93696c4/COC1%253DCC%253DC%2528C%253DC1OC%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC2%253DNN%2528N%253DC2C%253DC1%2529C1%253DCC%253DC%2528C%2529C%253DC1.png)
![Chemical structure of 3-[2-(4-chlorophenyl)-2H-1,2,3-benzotriazol-5-yl]-1-(3,4-dimethoxybenzoyl)thiourea - CSSB00121603352](/st/structure/200/475422f84fcc21c6a4b8ac5b55dfb052/COC1%253DCC%253DC%2528C%253DC1OC%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC2%253DNN%2528N%253DC2C%253DC1%2529C1%253DCC%253DC%2528Cl%2529C%253DC1.png)
![Chemical structure of 1-(3,4-dimethoxybenzoyl)-3-[6-methyl-2-(4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea - CSSB00121706526](/st/structure/200/a82c6ce21c988b52966da745cbb1600b/COC1%253DCC%253DC%2528C%253DC1OC%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC2%253DNN%2528N%253DC2C%253DC1C%2529C1%253DCC%253DC%2528C%2529C%253DC1.png)
![Chemical structure of 1-(3,4-dimethoxybenzoyl)-3-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea - CSSB00121706527](/st/structure/200/f4b7a0b38cd848ed01d7fc7e11bc800b/CCOC1%253DCC%253DC%2528C%253DC1%2529N1N%253DC2C%253DCC%2528NC%2528%253DS%2529NC%2528%253DO%2529C3%253DCC%253DC%2528OC%2529C%2528OC%2529%253DC3%2529%253DCC2%253DN1.png)
![Chemical structure of 3-[6-methyl-2-(4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-1-(3,4,5-trimethoxybenzoyl)thiourea - CSSB00121706449](/st/structure/200/3dbf75e61733adbb6c22b49f312e4c7a/COC1%253DCC%2528%253DCC%2528OC%2529%253DC1OC%2529C%2528%253DO%2529NC%2528%253DS%2529NC1%253DCC2%253DNN%2528N%253DC2C%253DC1C%2529C1%253DCC%253DC%2528C%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of 3-[2-(4-ethoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-1-(4-methoxy-3-nitrobenzoyl)thiourea - CSSB00121706331](/st/structure/200/41d097164b4f5519da72f745e06b7e9f/CCOC1%253DCC%253DC%2528C%253DC1%2529N1N%253DC2C%253DCC%2528NC%2528%253DS%2529NC%2528%253DO%2529C3%253DCC%253DC%2528OC%2529C%2528%253DC3%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529%253DCC2%253DN1.png)
