4-amino-1-(4-chlorophenyl)-3,7,7-trimethyl-1,6,7,8-tetrahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
4-amino-1-(4-chlorophenyl)-3,7,7-trimethyl-1,6,7,8-tetrahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-amino-1-(4-chlorophenyl)-3,7,7-trimethyl-1,6,7,8-tetrahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | Y021-1222 |
| Compound Name: | 4-amino-1-(4-chlorophenyl)-3,7,7-trimethyl-1,6,7,8-tetrahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 354.84 |
| Molecular Formula: | C19 H19 Cl N4 O |
| Smiles: | Cc1c2c(c3C(CC(C)(C)Cc3nc2n(c2ccc(cc2)[Cl])n1)=O)N |
| Stereo: | ACHIRAL |
| logP: | 3.577 |
| logD: | 3.577 |
| logSw: | -4.4431 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.69 |
| InChI Key: | AFUBMJRIYUUDBS-UHFFFAOYSA-N |