(3S,5R)-5-(hydroxymethyl)-1,3-dimethyl-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-2-one
Chemical Structure Depiction of
(3S,5R)-5-(hydroxymethyl)-1,3-dimethyl-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-2-one
(3S,5R)-5-(hydroxymethyl)-1,3-dimethyl-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-2-one
Compound characteristics
| Compound ID: | S973-0070 |
| Compound Name: | (3S,5R)-5-(hydroxymethyl)-1,3-dimethyl-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-2-one |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C17 H24 N2 O4 S |
| Smiles: | C[C@H]1C(N(C)C[C@H](CO)N1S(c1ccc2CCCCc2c1)(=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5784 |
| logD: | 1.5784 |
| logSw: | -2.3525 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.294 |
| InChI Key: | TZUQSMYXWHOAEY-SWLSCSKDSA-N |