N-(2-{4-[4-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}pyridin-3-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-{4-[4-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}pyridin-3-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-{4-[4-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}pyridin-3-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V014-3004 |
| Compound Name: | N-(2-{4-[4-(trifluoromethyl)benzene-1-sulfonyl]piperazin-1-yl}pyridin-3-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 534.51 |
| Molecular Formula: | C24 H21 F3 N4 O5 S |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1S(c1ccc(cc1)C(F)(F)F)(=O)=O)c1c(cccn1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2125 |
| logD: | 4.1965 |
| logSw: | -4.32 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.699 |
| InChI Key: | FHHWOPLSNNNBHY-UHFFFAOYSA-N |