3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | C200-7044 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 367.38 |
| Molecular Formula: | C20 H18 F N3 O3 |
| Smiles: | COc1ccc(CCN2C=Nc3c4cc(ccc4[nH]c3C2=O)F)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.4203 |
| logD: | 2.4203 |
| logSw: | -2.8279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.536 |
| InChI Key: | PAWUSWCSUOTYOO-UHFFFAOYSA-N |