3-{3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-{3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0212 |
| Compound Name: | 3-{3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C26 H29 N5 O2 |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(CCN1C=Nc2c3cc(C)ccc3[nH]c2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7552 |
| logD: | 3.7549 |
| logSw: | -4.0544 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.627 |
| InChI Key: | ODMKORVZKAJKIW-UHFFFAOYSA-N |