7,8-dimethoxy-3-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
7,8-dimethoxy-3-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
7,8-dimethoxy-3-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | C200-7870 |
| Compound Name: | 7,8-dimethoxy-3-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C25 H27 N5 O4 |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)C(CN1C=Nc2c3cc(c(cc3[nH]c2C1=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7541 |
| logD: | 1.754 |
| logSw: | -2.3399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.211 |
| InChI Key: | GHBILGVISFZESG-UHFFFAOYSA-N |