2-(2-cyanoanilino)-2-oxoethyl N-benzoyl-S-benzylcysteinate
Chemical Structure Depiction of
2-(2-cyanoanilino)-2-oxoethyl N-benzoyl-S-benzylcysteinate
2-(2-cyanoanilino)-2-oxoethyl N-benzoyl-S-benzylcysteinate
Compound characteristics
| Compound ID: | 8017-0174 |
| Compound Name: | 2-(2-cyanoanilino)-2-oxoethyl N-benzoyl-S-benzylcysteinate |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C26 H23 N3 O4 S |
| Smiles: | C(C(Nc1ccccc1C#N)=O)OC(C(CSCc1ccccc1)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4097 |
| logD: | 3.4086 |
| logSw: | -3.9356 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.648 |
| InChI Key: | BWHBZFYKCTVPFY-QHCPKHFHSA-N |