N-cyclopropyl-4-{[2-{[2-(3,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-{[2-{[2-(3,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopropyl-4-{[2-{[2-(3,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0147 |
| Compound Name: | N-cyclopropyl-4-{[2-{[2-(3,5-dimethoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 544.63 |
| Molecular Formula: | C29 H28 N4 O5 S |
| Smiles: | COc1cc(cc(c1)OC)NC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7472 |
| logD: | 3.7471 |
| logSw: | -3.9829 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.478 |
| InChI Key: | WSHDMUWHRXDRJG-UHFFFAOYSA-N |