N-cyclopropyl-4-{[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-{[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopropyl-4-{[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0123 |
| Compound Name: | N-cyclopropyl-4-{[2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C28 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1)NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0315 |
| logD: | 4.0315 |
| logSw: | -4.1829 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.39 |
| InChI Key: | KNJRQVLQWPHYEO-UHFFFAOYSA-N |