4-{[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-propylbenzamide
Chemical Structure Depiction of
4-{[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-propylbenzamide
4-{[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-propylbenzamide
Compound characteristics
| Compound ID: | G629-0008 |
| Compound Name: | 4-{[2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-propylbenzamide |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C26 H24 F N3 O2 S |
| Smiles: | CCCNC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCc2cccc(c2)F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6125 |
| logD: | 4.6125 |
| logSw: | -4.3273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.297 |
| InChI Key: | KCQUBWJFWXYSDJ-UHFFFAOYSA-N |