4-{2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-{2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-{2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | D361-0033 |
| Compound Name: | 4-{2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 397.86 |
| Molecular Formula: | C21 H20 Cl N3 O3 |
| Smiles: | Cc1c2C(CC(Nc2[nH]n1)=O)c1cccc(c1OCc1ccc(cc1)[Cl])OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5196 |
| logD: | 3.5192 |
| logSw: | -3.8919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.733 |
| InChI Key: | KQMSNSYJIILCPG-MRXNPFEDSA-N |