N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-2,5-dimethylfuran-3-carboxamide
Chemical Structure Depiction of
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-2,5-dimethylfuran-3-carboxamide
N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-2,5-dimethylfuran-3-carboxamide
Compound characteristics
| Compound ID: | S925-0021 |
| Compound Name: | N-({(2R,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-2,5-dimethylfuran-3-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C22 H29 N3 O3 |
| Smiles: | Cc1cccc(CN2[C@@H](C)C(N(C)C[C@H]2CNC(c2cc(C)oc2C)=O)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 2.9362 |
| logD: | 2.9313 |
| logSw: | -3.3398 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.218 |
| InChI Key: | LELTZYBYSQRCHL-LPHOPBHVSA-N |