N-benzyl-1-[(4-chlorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(4-chlorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
N-benzyl-1-[(4-chlorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-3091 |
| Compound Name: | N-benzyl-1-[(4-chlorophenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 449.96 |
| Molecular Formula: | C21 H24 Cl N3 O4 S |
| Smiles: | CC1(CN(CC(N1Cc1ccc(cc1)[Cl])=O)S(C)(=O)=O)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4672 |
| logD: | 2.4672 |
| logSw: | -3.307 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.045 |
| InChI Key: | LOAYIWTZMXYENP-NRFANRHFSA-N |