methyl ({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
Chemical Structure Depiction of
methyl ({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
methyl ({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y503-4588 |
| Compound Name: | methyl ({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetate |
| Molecular Weight: | 406.89 |
| Molecular Formula: | C18 H19 Cl N4 O3 S |
| Smiles: | Cc1c(cn(CCCN2C(=Nc3ccccc3C2=O)SCC(=O)OC)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.9915 |
| logD: | 1.9915 |
| logSw: | -2.9102 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.708 |
| InChI Key: | XVGJXXPUASHRAV-UHFFFAOYSA-N |