4-chloro-N-(5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-(5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-3-nitrobenzamide
4-chloro-N-(5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8018-8018 |
| Compound Name: | 4-chloro-N-(5-chloro-1,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-3-nitrobenzamide |
| Molecular Weight: | 394.21 |
| Molecular Formula: | C16 H13 Cl2 N5 O3 |
| Smiles: | Cc1c(c(C)nc2c1c(NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)nn2C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3506 |
| logD: | 0.1181 |
| logSw: | -4.2204 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.867 |
| InChI Key: | XPNLIDYNXNMJLX-UHFFFAOYSA-N |