6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
Chemical Structure Depiction of
6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate
Compound characteristics
| Compound ID: | Y041-1498 |
| Compound Name: | 6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexane-1-carboxylate |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C29 H31 N O6 |
| Smiles: | Cc1c(ccc2C3CCCC=3C(=O)Oc12)OC(C1CCC(CC1)CNC(=O)OCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6523 |
| logD: | 5.6523 |
| logSw: | -5.5454 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.657 |
| InChI Key: | ZBNWDFJZWLYTJL-UHFFFAOYSA-N |