5-[(2,5-dimethylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(2,5-dimethylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(2,5-dimethylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0332 |
| Compound Name: | 5-[(2,5-dimethylphenyl)methyl]-8-fluoro-3-[(4-fluorophenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C26 H21 F2 N3 O |
| Smiles: | Cc1ccc(C)c(Cn2c3C(N(Cc4ccc(cc4)F)C=Nc3c3cc(ccc23)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7629 |
| logD: | 5.7629 |
| logSw: | -5.5057 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | XKWOQQIZQMMQNN-UHFFFAOYSA-N |