3-(3,5-dimethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,5-dimethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
3-(3,5-dimethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0132 |
| Compound Name: | 3-(3,5-dimethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 513.66 |
| Molecular Formula: | C30 H31 N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(=Nc2cc(ccc2C1=O)C(N1CCCCC1)=O)SCc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.416 |
| logD: | 5.4117 |
| logSw: | -5.2336 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.352 |
| InChI Key: | WMJBONWTPOKWBS-UHFFFAOYSA-N |