3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y503-4619 |
| Compound Name: | 3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 402.86 |
| Molecular Formula: | C17 H15 Cl N6 O2 S |
| Smiles: | Cc1c(CSC2=Nc3ccccc3C(N2CCn2cc(cn2)[Cl])=O)non1 |
| Stereo: | ACHIRAL |
| logP: | 2.3747 |
| logD: | 2.3747 |
| logSw: | -3.2194 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 77.965 |
| InChI Key: | XUNCBHHLJIWRNT-UHFFFAOYSA-N |