N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-methylbenzene-1-sulfonamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V009-9964 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{4-[3-fluoro-5-(trifluoromethyl)benzoyl]piperazin-1-yl}-4-methoxy-N-methylbenzene-1-sulfonamide |
| Molecular Weight: | 639.67 |
| Molecular Formula: | C30 H33 F4 N3 O6 S |
| Salt: | not_available |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)S(c1ccc(c(c1)N1CCN(CC1)C(c1cc(cc(c1)F)C(F)(F)F)=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9543 |
| logD: | 4.9543 |
| logSw: | -4.7783 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.28 |
| InChI Key: | WKYQVPVYBJLRIZ-UHFFFAOYSA-N |