N-(3-chloro-4-fluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
N-(3-chloro-4-fluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E975-1180 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)propanamide |
| Molecular Weight: | 412.82 |
| Molecular Formula: | C17 H14 Cl F N2 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(CCC(Nc1ccc(c(c1)[Cl])F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2607 |
| logD: | 2.1805 |
| logSw: | -3.4909 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.018 |
| InChI Key: | YSXAQJZZFGOLMR-UHFFFAOYSA-N |