1-(3-chloro-2-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
1-(3-chloro-2-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
1-(3-chloro-2-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-3677 |
| Compound Name: | 1-(3-chloro-2-methylphenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C21 H23 Cl F N3 O4 S |
| Smiles: | Cc1c(cccc1[Cl])N1C(CN(CC1(C)C(NCc1ccc(cc1)F)=O)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6169 |
| logD: | 2.6168 |
| logSw: | -3.3923 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.133 |
| InChI Key: | AIIASSNUVKJTAP-NRFANRHFSA-N |