4-{[6-chloro-2-{[2-(3-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
4-{[6-chloro-2-{[2-(3-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
4-{[6-chloro-2-{[2-(3-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | G629-0312 |
| Compound Name: | 4-{[6-chloro-2-{[2-(3-ethylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(propan-2-yl)benzamide |
| Molecular Weight: | 549.09 |
| Molecular Formula: | C29 H29 Cl N4 O3 S |
| Smiles: | CCc1cccc(c1)NC(CSC1=Nc2ccc(cc2C(N1Cc1ccc(cc1)C(NC(C)C)=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5147 |
| logD: | 5.5147 |
| logSw: | -5.7998 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.579 |
| InChI Key: | PNYYVERQRIVUMJ-UHFFFAOYSA-N |