N-[2-(4-chlorophenyl)ethyl]-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)valinamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)valinamide
N-[2-(4-chlorophenyl)ethyl]-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)valinamide
Compound characteristics
| Compound ID: | C562-1639 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-N~2~-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)valinamide |
| Molecular Weight: | 465.95 |
| Molecular Formula: | C21 H24 Cl N3 O5 S |
| Smiles: | CC(C)C(C(NCCc1ccc(cc1)[Cl])=O)NS(c1ccc2c(c1)OC(N2C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9054 |
| logD: | 2.9051 |
| logSw: | -3.8042 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.954 |
| InChI Key: | SAQBJBGNSYRBLU-IBGZPJMESA-N |