4-{[2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
Chemical Structure Depiction of
4-{[2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
4-{[2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide
Compound characteristics
| Compound ID: | G629-0137 |
| Compound Name: | 4-{[2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclopropylbenzamide |
| Molecular Weight: | 533.05 |
| Molecular Formula: | C28 H25 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CC1)=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0653 |
| logD: | 4.0652 |
| logSw: | -4.4099 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.692 |
| InChI Key: | SDBIEHNQKNMCFO-UHFFFAOYSA-N |