2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D365-0016 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroquinazolin-4(3H)-one |
| Molecular Weight: | 328.47 |
| Molecular Formula: | C19 H24 N2 O S |
| Smiles: | CC(C)(C)c1ccc(CSC2NC(C3CCCCC=3N=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2766 |
| logD: | 4.1356 |
| logSw: | -4.1219 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.472 |
| InChI Key: | KQZWJHUOAJXPAP-UHFFFAOYSA-N |