methyl 3-(3-chloro-4-fluorophenyl)-2-[4-(ethoxycarbonyl)piperazin-1-yl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3-chloro-4-fluorophenyl)-2-[4-(ethoxycarbonyl)piperazin-1-yl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-(3-chloro-4-fluorophenyl)-2-[4-(ethoxycarbonyl)piperazin-1-yl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0417 |
| Compound Name: | methyl 3-(3-chloro-4-fluorophenyl)-2-[4-(ethoxycarbonyl)piperazin-1-yl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 488.9 |
| Molecular Formula: | C23 H22 Cl F N4 O5 |
| Smiles: | CCOC(N1CCN(CC1)C1=Nc2cc(ccc2C(N1c1ccc(c(c1)[Cl])F)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4042 |
| logD: | 3.4042 |
| logSw: | -3.8965 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.165 |
| InChI Key: | KVMQADZLIFEESK-UHFFFAOYSA-N |