N-cyclopentyl-4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopentyl-4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopentyl-4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0182 |
| Compound Name: | N-cyclopentyl-4-{[2-{[(3-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C29 H29 N3 O2 S |
| Smiles: | Cc1cccc(CSC2=Nc3ccccc3C(N2Cc2ccc(cc2)C(NC2CCCC2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7885 |
| logD: | 5.7885 |
| logSw: | -5.3994 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.276 |
| InChI Key: | PSJKCPQMNIQUIE-UHFFFAOYSA-N |