2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0201 |
| Compound Name: | 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-3-(4-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 524.01 |
| Molecular Formula: | C27 H23 Cl F N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C(=Nc2cc(ccc2C1=O)C(N1CCCC1)=O)SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.9201 |
| logD: | 4.92 |
| logSw: | -5.0136 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.718 |
| InChI Key: | CKQZNDILHGRVTB-UHFFFAOYSA-N |