N-[(4-chlorophenyl)methyl]-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
N-[(4-chlorophenyl)methyl]-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | E786-1895 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5-[(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)methyl]thiophene-2-sulfonamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C19 H14 Cl N3 O4 S2 |
| Smiles: | C(c1ccc(cc1)[Cl])NS(c1ccc(CN2C(c3cccnc3C2=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3803 |
| logD: | 2.3797 |
| logSw: | -3.5042 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.177 |
| InChI Key: | MKRLXKYUCATZOJ-UHFFFAOYSA-N |