2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0391 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 550.08 |
| Molecular Formula: | C29 H28 Cl N3 O4 S |
| Smiles: | COc1cc(cc(c1)OC)N1C(=Nc2cc(ccc2C1=O)C(N1CCCCC1)=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3801 |
| logD: | 5.3799 |
| logSw: | -5.7935 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.895 |
| InChI Key: | VXBTTWZIODOGAV-UHFFFAOYSA-N |