4-{[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
Chemical Structure Depiction of
4-{[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
4-{[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
Compound characteristics
| Compound ID: | G629-0122 |
| Compound Name: | 4-{[2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide |
| Molecular Weight: | 519.02 |
| Molecular Formula: | C27 H23 Cl N4 O3 S |
| Smiles: | C1CC1NC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCC(Nc2ccccc2[Cl])=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6589 |
| logD: | 3.6588 |
| logSw: | -4.1227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.692 |
| InChI Key: | HGFIEAGSFGZCML-UHFFFAOYSA-N |