4-({2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-[(oxolan-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-[(oxolan-2-yl)methyl]cyclohexane-1-carboxamide
4-({2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-[(oxolan-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K284-4751 |
| Compound Name: | 4-({2-[(1-{[(furan-2-yl)methyl]amino}-1-oxobutan-2-yl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-[(oxolan-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 566.72 |
| Molecular Formula: | C30 H38 N4 O5 S |
| Smiles: | CCC(C(NCc1ccco1)=O)SC1=Nc2ccccc2C(N1CC1CCC(CC1)C(NCC1CCCO1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0752 |
| logD: | 4.0752 |
| logSw: | -4.2426 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.465 |
| InChI Key: | LZZNPOFXBYDHPO-UHFFFAOYSA-N |