N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Chemical Structure Depiction of
N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
Compound characteristics
| Compound ID: | S925-0730 |
| Compound Name: | N-({(2S,6S)-4,6-dimethyl-5-oxo-1-[(pyridin-3-yl)methyl]piperazin-2-yl}methyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Smiles: | C[C@H]1C(N(C)C[C@@H](CNS(c2ccc3CCCCc3c2)(=O)=O)N1Cc1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.2646 |
| logD: | 2.2643 |
| logSw: | -2.6679 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.254 |
| InChI Key: | SFKBHCRHDNRCPP-LAUBAEHRSA-N |