3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y503-4365 |
| Compound Name: | 3-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 444.94 |
| Molecular Formula: | C20 H21 Cl N6 O2 S |
| Smiles: | Cc1c(c(C)n(CCCN2C(=Nc3ccccc3C2=O)SCc2c(C)non2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.8889 |
| logD: | 2.8889 |
| logSw: | -3.881 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.742 |
| InChI Key: | YYRQEIZJWDISAG-UHFFFAOYSA-N |