N-(2-{[(2-fluorophenyl)methyl]sulfanyl}ethyl)-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
Chemical Structure Depiction of
N-(2-{[(2-fluorophenyl)methyl]sulfanyl}ethyl)-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
N-(2-{[(2-fluorophenyl)methyl]sulfanyl}ethyl)-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyrimidine-5-sulfonamide
Compound characteristics
| Compound ID: | D698-0035 |
| Compound Name: | N-(2-{[(2-fluorophenyl)methyl]sulfanyl}ethyl)-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyrimidine-5-sulfonamide |
| Molecular Weight: | 373.42 |
| Molecular Formula: | C14 H16 F N3 O4 S2 |
| Smiles: | CC1=C(C(NC(=N1)O)=O)S(NCCSCc1ccccc1F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7941 |
| logD: | -5.8428 |
| logSw: | -2.1941 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.618 |
| InChI Key: | GDYFYSWLWKHWGW-UHFFFAOYSA-N |