N-(4-cyanophenyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-(4-cyanophenyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F952-1307 |
| Compound Name: | N-(4-cyanophenyl)-3-[3-(morpholin-4-yl)-3-oxopropyl]-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C21 H20 N4 O5 S2 |
| Smiles: | C(CN1C(=O)Sc2cc(ccc12)S(Nc1ccc(C#N)cc1)(=O)=O)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0626 |
| logD: | 1.7814 |
| logSw: | -2.903 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.797 |
| InChI Key: | CXRDYWPFVHOUCM-UHFFFAOYSA-N |