3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F796-0568 |
| Compound Name: | 3-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | C1CN(CCN1C(CN1C=Nc2c3ccccc3[nH]c2C1=O)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.2867 |
| logD: | 2.2867 |
| logSw: | -3.5001 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.95 |
| InChI Key: | VCIYYTWCMIOYSK-UHFFFAOYSA-N |