1-(3-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
1-(3-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
1-(3-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-3651 |
| Compound Name: | 1-(3-chlorophenyl)-N-[(4-fluorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 453.92 |
| Molecular Formula: | C20 H21 Cl F N3 O4 S |
| Smiles: | CC1(CN(CC(N1c1cccc(c1)[Cl])=O)S(C)(=O)=O)C(NCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1475 |
| logD: | 2.1474 |
| logSw: | -3.2929 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.434 |
| InChI Key: | HDGFZHZEUSVJFQ-FQEVSTJZSA-N |