7,8-dimethoxy-3-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
7,8-dimethoxy-3-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
7,8-dimethoxy-3-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0496 |
| Compound Name: | 7,8-dimethoxy-3-{3-[4-(2-methoxyphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 491.55 |
| Molecular Formula: | C26 H29 N5 O5 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CCN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5579 |
| logD: | 1.5577 |
| logSw: | -2.2101 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.519 |
| InChI Key: | JZSOFYHKLHKHGM-UHFFFAOYSA-N |