N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-3-carboxamide
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | S925-0121 |
| Compound Name: | N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C21 H29 N5 O2 |
| Smiles: | CCn1ccc(C(NC[C@@H]2CN(C)C([C@H](C)N2Cc2cccc(C)c2)=O)=O)n1 |
| Stereo: | ABSOLUTE |
| logP: | 1.6107 |
| logD: | 1.6001 |
| logSw: | -2.1633 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.856 |
| InChI Key: | CASBUGNHZQIYON-WMZOPIPTSA-N |