ethyl 4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}piperidine-1-carboxylate
ethyl 4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | K284-3457 |
| Compound Name: | ethyl 4-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}piperidine-1-carboxylate |
| Molecular Weight: | 498.64 |
| Molecular Formula: | C26 H34 N4 O4 S |
| Smiles: | CCOC(N1CCC(CC1)N1C(=Nc2ccccc2C1=O)SCC(NCCC1CCCCC=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4106 |
| logD: | 3.4106 |
| logSw: | -3.8487 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.278 |
| InChI Key: | LVXOMMOCZYAUFE-UHFFFAOYSA-N |