N-benzyl-1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
N-benzyl-1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-3167 |
| Compound Name: | N-benzyl-1-[(4-ethoxy-3-methoxyphenyl)methyl]-4-(methanesulfonyl)-2-methyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C24 H31 N3 O6 S |
| Smiles: | CCOc1ccc(CN2C(CN(CC2(C)C(NCc2ccccc2)=O)S(C)(=O)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7911 |
| logD: | 1.791 |
| logSw: | -2.653 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.886 |
| InChI Key: | MPYVSRMTITWPMP-DEOSSOPVSA-N |