N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(4-methylphenyl)valinamide
Chemical Structure Depiction of
N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(4-methylphenyl)valinamide
N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(4-methylphenyl)valinamide
Compound characteristics
| Compound ID: | C562-1821 |
| Compound Name: | N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)-N-(4-methylphenyl)valinamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | CC(C)C(C(Nc1ccc(C)cc1)=O)NS(c1ccc2c(c1)OC(N2C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0005 |
| logD: | 3.0002 |
| logSw: | -3.6458 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.791 |
| InChI Key: | SCSZWTLFFDRMRC-SFHVURJKSA-N |