N-(3-chloro-4-methylphenyl)-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
N-(3-chloro-4-methylphenyl)-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Compound characteristics
| Compound ID: | C562-1536 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide |
| Molecular Weight: | 499.97 |
| Molecular Formula: | C24 H22 Cl N3 O5 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(C(Cc1ccccc1)NS(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8506 |
| logD: | 4.8432 |
| logSw: | -4.9597 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.798 |
| InChI Key: | KCVVKWAXQZYQKO-FQEVSTJZSA-N |