4-{[2-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-{[2-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(2-methoxyethyl)benzamide
4-{[2-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | G629-0277 |
| Compound Name: | 4-{[2-{[2-(3-fluoro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 534.61 |
| Molecular Formula: | C28 H27 F N4 O4 S |
| Smiles: | Cc1ccc(cc1F)NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NCCOC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8051 |
| logD: | 3.805 |
| logSw: | -3.9372 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.789 |
| InChI Key: | SCLXJTLPAUYJNU-UHFFFAOYSA-N |