3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y503-4308 |
| Compound Name: | 3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C22 H21 Cl N4 O S |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3ccccc3C(N2CCn2cc(cn2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.894 |
| logD: | 4.894 |
| logSw: | -4.8224 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.505 |
| InChI Key: | FDURNTNTLACHLX-UHFFFAOYSA-N |