3-[2-(3-ethoxy-4-methoxyphenyl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[2-(3-ethoxy-4-methoxyphenyl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[2-(3-ethoxy-4-methoxyphenyl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0123 |
| Compound Name: | 3-[2-(3-ethoxy-4-methoxyphenyl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C22 H23 N3 O3 |
| Smiles: | CCOc1cc(CCN2C=Nc3c4cc(C)ccc4[nH]c3C2=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9553 |
| logD: | 2.9553 |
| logSw: | -3.1837 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.116 |
| InChI Key: | ZKYLDOLXLHORDJ-UHFFFAOYSA-N |