2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(prop-2-en-1-yl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-0869 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(prop-2-en-1-yl)quinazolin-4(3H)-one |
| Molecular Weight: | 364.51 |
| Molecular Formula: | C22 H24 N2 O S |
| Smiles: | CC(C)(C)c1ccc(CSC2=Nc3ccccc3C(N2CC=C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1684 |
| logD: | 5.1684 |
| logSw: | -4.936 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.0209 |
| InChI Key: | GJIWEZZHNVFRSL-UHFFFAOYSA-N |