N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-hydroxy-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
Chemical Structure Depiction of
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-hydroxy-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-hydroxy-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
Compound characteristics
| Compound ID: | D698-0009 |
| Compound Name: | N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-hydroxy-6-oxo-1,6-dihydropyrimidine-5-sulfonamide |
| Molecular Weight: | 361.82 |
| Molecular Formula: | C12 H12 Cl N3 O4 S2 |
| Smiles: | C(CSc1ccc(cc1)[Cl])NS(C1=CN=C(NC1=O)O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8668 |
| logD: | -5.994 |
| logSw: | -2.6365 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.956 |
| InChI Key: | NCQOFRTUCTVJTG-UHFFFAOYSA-N |