methyl 4-{[4-(4-bromophenyl)-2-methyl-3-oxopiperazin-1-yl]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(4-bromophenyl)-2-methyl-3-oxopiperazin-1-yl]methyl}benzoate
methyl 4-{[4-(4-bromophenyl)-2-methyl-3-oxopiperazin-1-yl]methyl}benzoate
Compound characteristics
| Compound ID: | V028-8233 |
| Compound Name: | methyl 4-{[4-(4-bromophenyl)-2-methyl-3-oxopiperazin-1-yl]methyl}benzoate |
| Molecular Weight: | 417.3 |
| Molecular Formula: | C20 H21 Br N2 O3 |
| Salt: | not_available |
| Smiles: | CC1C(N(CCN1Cc1ccc(cc1)C(=O)OC)c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9314 |
| logD: | 3.9313 |
| logSw: | -4.0845 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.4 |
| InChI Key: | ZYPYHGTXHOACCL-AWEZNQCLSA-N |