N-cyclopropyl-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopropyl-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0112 |
| Compound Name: | N-cyclopropyl-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C27 H25 N3 O2 S |
| Smiles: | Cc1ccccc1CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0104 |
| logD: | 5.0104 |
| logSw: | -4.4762 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.241 |
| InChI Key: | CHTWBVAFDCDBEH-UHFFFAOYSA-N |