2-(3-chloro-4-methylanilino)-2-oxoethyl N-benzoylmethioninate
Chemical Structure Depiction of
2-(3-chloro-4-methylanilino)-2-oxoethyl N-benzoylmethioninate
2-(3-chloro-4-methylanilino)-2-oxoethyl N-benzoylmethioninate
Compound characteristics
| Compound ID: | 8008-3420 |
| Compound Name: | 2-(3-chloro-4-methylanilino)-2-oxoethyl N-benzoylmethioninate |
| Molecular Weight: | 434.94 |
| Molecular Formula: | C21 H23 Cl N2 O4 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(COC(C(CCSC)NC(c1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0686 |
| logD: | 4.0684 |
| logSw: | -4.3394 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.561 |
| InChI Key: | YEJRAHWZXXKOQR-SFHVURJKSA-N |