2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0293 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C29 H29 N3 O3 S |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3cc(ccc3C(N2c2cccc(c2)OC)=O)C(N2CCCC2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4295 |
| logD: | 5.4288 |
| logSw: | -5.2859 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.718 |
| InChI Key: | ANSKTYVQMDDQAV-UHFFFAOYSA-N |