N-[(furan-2-yl)methyl]-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
N-[(furan-2-yl)methyl]-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4798 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 558.7 |
| Molecular Formula: | C31 H34 N4 O4 S |
| Smiles: | Cc1ccc(CNC(CSC2=Nc3ccccc3C(N2CC2CCC(CC2)C(NCc2ccco2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.776 |
| logD: | 4.776 |
| logSw: | -4.5964 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.597 |
| InChI Key: | FRSXNSJRGXGDNU-UHFFFAOYSA-N |