N-[(furan-2-yl)methyl]-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
N-[(furan-2-yl)methyl]-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4765 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-{[2-{[(2-methylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 501.65 |
| Molecular Formula: | C29 H31 N3 O3 S |
| Smiles: | Cc1ccccc1CSC1=Nc2ccccc2C(N1CC1CCC(CC1)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0735 |
| logD: | 6.0735 |
| logSw: | -5.5426 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.125 |
| InChI Key: | HBFXYPOSYVNXBC-UHFFFAOYSA-N |