({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetonitrile
Chemical Structure Depiction of
({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetonitrile
({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetonitrile
Compound characteristics
| Compound ID: | Y503-4380 |
| Compound Name: | ({3-[3-(4-chloro-3-methyl-1H-pyrazol-1-yl)propyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)acetonitrile |
| Molecular Weight: | 373.86 |
| Molecular Formula: | C17 H16 Cl N5 O S |
| Smiles: | Cc1c(cn(CCCN2C(=Nc3ccccc3C2=O)SCC#N)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.96 |
| logD: | 1.96 |
| logSw: | -2.9357 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.621 |
| InChI Key: | YABSCEDMTHHJOY-UHFFFAOYSA-N |