N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S925-0126 |
| Compound Name: | N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C21 H29 N5 O2 |
| Smiles: | Cc1cccc(CN2[C@@H](C)C(N(C)C[C@H]2CNC(c2cc(C)nn2C)=O)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 1.3329 |
| logD: | 1.3224 |
| logSw: | -2.0508 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.793 |
| InChI Key: | OTVIGQFHDDOZMA-WMZOPIPTSA-N |