methyl 2-[butyl(methyl)amino]-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-[butyl(methyl)amino]-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-[butyl(methyl)amino]-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0429 |
| Compound Name: | methyl 2-[butyl(methyl)amino]-3-(3-chloro-4-fluorophenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 417.87 |
| Molecular Formula: | C21 H21 Cl F N3 O3 |
| Smiles: | CCCCN(C)C1=Nc2cc(ccc2C(N1c1ccc(c(c1)[Cl])F)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9369 |
| logD: | 3.9368 |
| logSw: | -4.4319 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.137 |
| InChI Key: | GJWUWSPQMDURLH-UHFFFAOYSA-N |