N-[(4-chlorophenyl)methyl]-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-[(4-chlorophenyl)methyl]-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1004 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4H-[1]benzothiopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 356.83 |
| Molecular Formula: | C18 H13 Cl N2 O2 S |
| Smiles: | C(c1ccc(cc1)[Cl])NC(c1c2CSc3ccccc3c2on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0329 |
| logD: | 4.0329 |
| logSw: | -4.6243 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.733 |
| InChI Key: | RLVYBXWRQUWHTC-UHFFFAOYSA-N |