2-{[(4-tert-butylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
2-{[(4-tert-butylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 1774-0108 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 324.44 |
| Molecular Formula: | C19 H20 N2 O S |
| Smiles: | CC(C)(C)c1ccc(CSC2NC(c3ccccc3N=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3266 |
| logD: | 4.2465 |
| logSw: | -4.2837 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.501 |
| InChI Key: | CHLURYZQKUZOFQ-UHFFFAOYSA-N |