5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(4-sulfamoylphenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(4-sulfamoylphenyl)pyrimidine-4-carboxamide
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(4-sulfamoylphenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0020 |
| Compound Name: | 5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(4-sulfamoylphenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 452.91 |
| Molecular Formula: | C18 H14 Cl F N4 O3 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(cc1)F)[Cl])=O)c1ccc(cc1)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9337 |
| logD: | 2.7042 |
| logSw: | -3.5604 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.247 |
| InChI Key: | YAMQIBQYVSIEGS-UHFFFAOYSA-N |