N~1~-(4-fluorophenyl)-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~1~-propylethanediamide
Chemical Structure Depiction of
N~1~-(4-fluorophenyl)-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~1~-propylethanediamide
N~1~-(4-fluorophenyl)-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~1~-propylethanediamide
Compound characteristics
| Compound ID: | C909-0107 |
| Compound Name: | N~1~-(4-fluorophenyl)-N~2~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~1~-propylethanediamide |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C24 H25 F N4 O3 |
| Smiles: | CCCN(C(C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=O)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.4094 |
| logD: | 3.3778 |
| logSw: | -3.8572 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.684 |
| InChI Key: | LGAWVCWGCKVTHH-UHFFFAOYSA-N |