3-{3-[4-(4-chlorophenyl)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-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F797-0207 |
| Compound Name: | 3-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C24 H24 Cl N5 O2 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(CCC(N3CCN(CC3)c3ccc(cc3)[Cl])=O)C=N1)=O)[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.1338 |
| logD: | 3.1338 |
| logSw: | -3.5415 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.928 |
| InChI Key: | RFGJEMQVQZHXLH-UHFFFAOYSA-N |