methyl 2-(azepan-1-yl)-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-(azepan-1-yl)-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-(azepan-1-yl)-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0425 |
| Compound Name: | methyl 2-(azepan-1-yl)-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 429.88 |
| Molecular Formula: | C22 H21 Cl F N3 O3 |
| Smiles: | COC(c1ccc2C(N(C(=Nc2c1)N1CCCCCC1)c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3623 |
| logD: | 4.3623 |
| logSw: | -4.5756 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.716 |
| InChI Key: | ZIZSGZLENYQFBO-UHFFFAOYSA-N |