5-chloro-4-(chloromethyl)-1,3-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
5-chloro-4-(chloromethyl)-1,3-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
5-chloro-4-(chloromethyl)-1,3-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
Compound ID: | Y504-4976 |
Compound Name: | 5-chloro-4-(chloromethyl)-1,3-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one |
Molecular Weight: | 246.09 |
Molecular Formula: | C9 H9 Cl2 N3 O |
Smiles: | Cc1c2C(C[Cl])=C(C(Nc2n(C)n1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 1.1777 |
logD: | 0.8355 |
logSw: | -2.5862 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.841 |
InChI Key: | UMAGWCHZIPCKTM-UHFFFAOYSA-N |