N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | E734-2616 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-4-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 495.86 |
| Molecular Formula: | C21 H13 Cl F3 N3 O4 S |
| Smiles: | C(c1ccc(cc1)S(Nc1ccc(c(c1)C(F)(F)F)[Cl])(=O)=O)N1C(c2cccnc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5927 |
| logD: | 0.7985 |
| logSw: | -4.0263 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.05 |
| InChI Key: | QCTOLFKWVBLJFR-UHFFFAOYSA-N |