N-[(4-chlorophenyl)methyl]-1-{[4-(dimethylamino)phenyl]methyl}-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-1-{[4-(dimethylamino)phenyl]methyl}-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
N-[(4-chlorophenyl)methyl]-1-{[4-(dimethylamino)phenyl]methyl}-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-7150 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-1-{[4-(dimethylamino)phenyl]methyl}-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 493.02 |
| Molecular Formula: | C23 H29 Cl N4 O4 S |
| Smiles: | CC1(CN(CC(N1Cc1ccc(cc1)N(C)C)=O)S(C)(=O)=O)C(NCc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5572 |
| logD: | 2.5417 |
| logSw: | -3.4515 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.85 |
| InChI Key: | KXCFKECLITVXQX-QHCPKHFHSA-N |