N-(3-chloro-4-methoxyphenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-(3-chloro-4-methoxyphenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F952-0161 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 496 |
| Molecular Formula: | C21 H22 Cl N3 O5 S2 |
| Smiles: | COc1ccc(cc1[Cl])NS(c1ccc2c(c1)SC(N2CCC(N1CCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8254 |
| logD: | 3.5607 |
| logSw: | -4.2673 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.828 |
| InChI Key: | NDWRQHNMGQYPGS-UHFFFAOYSA-N |