3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-5-[(2-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-5-[(2-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-5-[(2-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0415 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-5-[(2-methylphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C28 H26 F N3 O3 |
| Smiles: | Cc1ccccc1Cn1c2C(N(CCc3ccc(c(c3)OC)OC)C=Nc2c2cc(ccc12)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2925 |
| logD: | 5.2925 |
| logSw: | -5.4805 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.168 |
| InChI Key: | MDWNZMOGUPPSQV-UHFFFAOYSA-N |