2-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0118 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-3-(3,5-dimethylphenyl)-7-(piperidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 518.08 |
| Molecular Formula: | C29 H28 Cl N3 O2 S |
| Smiles: | Cc1cc(C)cc(c1)N1C(=Nc2cc(ccc2C1=O)C(N1CCCCC1)=O)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.0193 |
| logD: | 6.0171 |
| logSw: | -5.8299 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.808 |
| InChI Key: | XNHIUEISQRMDQQ-UHFFFAOYSA-N |