N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Chemical Structure Depiction of
N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Compound characteristics
| Compound ID: | S925-0325 |
| Compound Name: | N-{[(2S,6S)-1,4-dimethyl-5-oxo-6-phenylpiperazin-2-yl]methyl}-5,6,7,8-tetrahydronaphthalene-2-sulfonamide |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C23 H29 N3 O3 S |
| Smiles: | CN1C[C@@H](CNS(c2ccc3CCCCc3c2)(=O)=O)N(C)[C@H](C1=O)c1ccccc1 |
| Stereo: | ABSOLUTE |
| logP: | 3.4899 |
| logD: | 3.4888 |
| logSw: | -3.8205 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.911 |
| InChI Key: | SHQUMHYCAVYNNK-IRLDBZIGSA-N |