2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}quinazolin-4(1H)-one
Chemical Structure Depiction of
2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}quinazolin-4(1H)-one
2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}quinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 8010-0507 |
| Compound Name: | 2-{[2-(3,4-dimethylphenoxy)ethyl]sulfanyl}quinazolin-4(1H)-one |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C18 H18 N2 O2 S |
| Smiles: | Cc1ccc(cc1C)OCCSC1Nc2ccccc2C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.33 |
| logD: | 3.9212 |
| logSw: | -4.2683 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.919 |
| InChI Key: | ULFHANIAHABPFQ-UHFFFAOYSA-N |