N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-4-carboxamide
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | S925-0119 |
| Compound Name: | N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1-ethyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C21 H29 N5 O2 |
| Smiles: | CCn1cc(cn1)C(NC[C@@H]1CN(C)C([C@H](C)N1Cc1cccc(C)c1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4554 |
| logD: | 1.4505 |
| logSw: | -2.0525 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.973 |
| InChI Key: | WZAQGXMZNZKGDU-LPHOPBHVSA-N |