3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-cyclohexylpropanamide
Chemical Structure Depiction of
3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-cyclohexylpropanamide
3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-cyclohexylpropanamide
Compound characteristics
| Compound ID: | K284-3053 |
| Compound Name: | 3-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-cyclohexylpropanamide |
| Molecular Weight: | 496.67 |
| Molecular Formula: | C27 H36 N4 O3 S |
| Smiles: | C1CCC(CC1)NC(CCN1C(=Nc2ccccc2C1=O)SCC(NCCC1CCCCC=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.479 |
| logD: | 3.479 |
| logSw: | -3.87 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.451 |
| InChI Key: | BMJIELQGGSNPJN-UHFFFAOYSA-N |