3-chloro-N-({2-(dimethylamino)-5-[(propane-1-sulfonyl)amino]phenyl}methyl)-N-(3-methylbutan-2-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-({2-(dimethylamino)-5-[(propane-1-sulfonyl)amino]phenyl}methyl)-N-(3-methylbutan-2-yl)benzene-1-sulfonamide
3-chloro-N-({2-(dimethylamino)-5-[(propane-1-sulfonyl)amino]phenyl}methyl)-N-(3-methylbutan-2-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V012-8076 |
| Compound Name: | 3-chloro-N-({2-(dimethylamino)-5-[(propane-1-sulfonyl)amino]phenyl}methyl)-N-(3-methylbutan-2-yl)benzene-1-sulfonamide |
| Molecular Weight: | 516.12 |
| Molecular Formula: | C23 H34 Cl N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CCCS(Nc1ccc(c(CN(C(C)C(C)C)S(c2cccc(c2)[Cl])(=O)=O)c1)N(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8046 |
| logD: | 5.7796 |
| logSw: | -5.9462 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.068 |
| InChI Key: | BIOCHANDUZSMIF-SFHVURJKSA-N |