6-amino-1-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-4,4-bis(trifluoromethyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Chemical Structure Depiction of
6-amino-1-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-4,4-bis(trifluoromethyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
6-amino-1-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-4,4-bis(trifluoromethyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile
Compound characteristics
| Compound ID: | 8012-6789 |
| Compound Name: | 6-amino-1-{4-[chloro(difluoro)methoxy]phenyl}-3-methyl-4,4-bis(trifluoromethyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carbonitrile |
| Molecular Weight: | 487.74 |
| Molecular Formula: | C17 H10 Cl F8 N5 O |
| Smiles: | Cc1c2c(NC(=C(C#N)C2(C(F)(F)F)C(F)(F)F)N)n(c2ccc(cc2)OC(F)(F)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9011 |
| logD: | 3.901 |
| logSw: | -4.7573 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.504 |
| InChI Key: | UHBBTOGQNNXWJG-UHFFFAOYSA-N |