N-({(2S,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-4-ethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-({(2S,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-4-ethylbenzene-1-sulfonamide
N-({(2S,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-4-ethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | S925-0107 |
| Compound Name: | N-({(2S,6S)-4,6-dimethyl-1-[(3-methylphenyl)methyl]-5-oxopiperazin-2-yl}methyl)-4-ethylbenzene-1-sulfonamide |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C23 H31 N3 O3 S |
| Smiles: | CCc1ccc(cc1)S(NC[C@@H]1CN(C)C([C@H](C)N1Cc1cccc(C)c1)=O)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.9101 |
| logD: | 3.9073 |
| logSw: | -3.841 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.816 |
| InChI Key: | IEVCIDDOJRQTEJ-GHTZIAJQSA-N |