N-[(4-methylphenyl)methyl]-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[(4-methylphenyl)methyl]-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F952-0069 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | Cc1ccc(CNS(c2ccc3c(c2)SC(N3CCC(N2CCCC2)=O)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6993 |
| logD: | 3.6989 |
| logSw: | -3.9432 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.306 |
| InChI Key: | DZRXKVCENYPMDO-UHFFFAOYSA-N |