N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-4-ethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-4-ethylbenzene-1-sulfonamide
N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-4-ethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | S925-0334 |
| Compound Name: | N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-4-ethylbenzene-1-sulfonamide |
| Molecular Weight: | 401.53 |
| Molecular Formula: | C21 H27 N3 O3 S |
| Smiles: | CCc1ccc(cc1)S(NC[C@@H]1CN(C)C([C@H](c2ccccc2)N1C)=O)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.1756 |
| logD: | 3.1745 |
| logSw: | -3.4455 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.991 |
| InChI Key: | DMCMDNCDCHZWNS-QUCCMNQESA-N |