4-methoxy-N-[(oxolan-2-yl)methyl]-3-{4-[2-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methoxy-N-[(oxolan-2-yl)methyl]-3-{4-[2-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}benzene-1-sulfonamide
4-methoxy-N-[(oxolan-2-yl)methyl]-3-{4-[2-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V013-5020 |
| Compound Name: | 4-methoxy-N-[(oxolan-2-yl)methyl]-3-{4-[2-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}benzene-1-sulfonamide |
| Molecular Weight: | 563.61 |
| Molecular Formula: | C23 H28 F3 N3 O6 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1N1CCN(CC1)S(c1ccccc1C(F)(F)F)(=O)=O)S(NCC1CCCO1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4589 |
| logD: | 3.4589 |
| logSw: | -3.9482 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.952 |
| InChI Key: | LDNOHTNNIGXQAO-QGZVFWFLSA-N |