3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0098 |
| Compound Name: | 3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C25 H27 N5 O2 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CCN1C=Nc2c3ccccc3[nH]c2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0723 |
| logD: | 3.0722 |
| logSw: | -3.2497 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.627 |
| InChI Key: | HCOJPODQGGZBEC-UHFFFAOYSA-N |