3-(3,5-dimethylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,5-dimethylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
3-(3,5-dimethylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0107 |
| Compound Name: | 3-(3,5-dimethylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C29 H29 N3 O2 S |
| Smiles: | Cc1ccc(CSC2=Nc3cc(ccc3C(N2c2cc(C)cc(C)c2)=O)C(N2CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2192 |
| logD: | 5.2148 |
| logSw: | -4.998 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.174 |
| InChI Key: | IQLDPLVMGDNFAG-UHFFFAOYSA-N |