3-chloro-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxamide
Chemical Structure Depiction of
3-chloro-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxamide
3-chloro-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | K308-0334 |
| Compound Name: | 3-chloro-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxamide |
| Molecular Weight: | 493.97 |
| Molecular Formula: | C26 H25 Cl F N5 O2 |
| Smiles: | C(CNC(C1C=CC2=Nc3cc(ccc3C(N2C=1)=O)[Cl])=O)CN1CCN(CC1)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.7541 |
| logD: | 2.2103 |
| logSw: | -3.6858 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.501 |
| InChI Key: | UGLHECQDDDEFHB-UHFFFAOYSA-N |