N-cyclopentyl-4-{[2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopentyl-4-{[2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
N-cyclopentyl-4-{[2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0193 |
| Compound Name: | N-cyclopentyl-4-{[2-{[(4-ethenylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C30 H29 N3 O2 S |
| Smiles: | C=Cc1ccc(CSC2=Nc3ccccc3C(N2Cc2ccc(cc2)C(NC2CCCC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4587 |
| logD: | 5.4587 |
| logSw: | -5.7031 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.276 |
| InChI Key: | QJFYMIFSDMDKDF-UHFFFAOYSA-N |