4-({2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
4-({2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4489 |
| Compound Name: | 4-({2-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-(2-phenylethyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 558.7 |
| Molecular Formula: | C31 H34 N4 O4 S |
| Smiles: | C1CC(CCC1CN1C(=Nc2ccccc2C1=O)SCC(NCc1ccco1)=O)C(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5262 |
| logD: | 4.5262 |
| logSw: | -4.5526 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.438 |
| InChI Key: | PVCNSGIRUSZVJM-UHFFFAOYSA-N |