N-(1,2-benzoxazol-3-yl)-5-{[(2-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
Chemical Structure Depiction of
N-(1,2-benzoxazol-3-yl)-5-{[(2-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
N-(1,2-benzoxazol-3-yl)-5-{[(2-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D050-0139 |
| Compound Name: | N-(1,2-benzoxazol-3-yl)-5-{[(2-methylphenyl)methanesulfonyl]methyl}furan-2-carboxamide |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C21 H18 N2 O5 S |
| Smiles: | Cc1ccccc1CS(Cc1ccc(C(Nc2c3ccccc3on2)=O)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2744 |
| logD: | 4.2632 |
| logSw: | -4.2477 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.268 |
| InChI Key: | JGRKPJPNLHZVMJ-UHFFFAOYSA-N |