3-[(2-chloro-4-fluorophenyl)methyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Chemical Structure Depiction of
3-[(2-chloro-4-fluorophenyl)methyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
3-[(2-chloro-4-fluorophenyl)methyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Compound characteristics
| Compound ID: | G663-0820 |
| Compound Name: | 3-[(2-chloro-4-fluorophenyl)methyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one |
| Molecular Weight: | 343.79 |
| Molecular Formula: | C18 H15 Cl F N3 O |
| Smiles: | C1CCc2c(C1)cc1C(N(Cc3ccc(cc3[Cl])F)C=Nc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1791 |
| logD: | 4.1761 |
| logSw: | -4.4965 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.952 |
| InChI Key: | ZIPVTTQQGXZYFV-UHFFFAOYSA-N |