2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0212 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 520.05 |
| Molecular Formula: | C28 H26 Cl N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C(=Nc2cc(ccc2C1=O)C(N1CCCCC1)=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9632 |
| logD: | 4.963 |
| logSw: | -5.0547 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.352 |
| InChI Key: | XDFGYJQBGMJOSX-UHFFFAOYSA-N |