N-{[4-(methylsulfanyl)phenyl]methyl}-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide
Compound characteristics
| Compound ID: | G706-1941 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-2-(propan-2-yl)-1,3-benzoxazole-6-carboxamide |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C19 H20 N2 O2 S |
| Smiles: | CC(C)c1nc2ccc(cc2o1)C(NCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.627 |
| logD: | 4.627 |
| logSw: | -4.3772 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.734 |
| InChI Key: | SXUJFEMKYQTFBR-UHFFFAOYSA-N |