4-({2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
4-({2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y040-8089 |
| Compound Name: | 4-({2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 413.47 |
| Molecular Formula: | C23 H27 N O6 |
| Smiles: | CC(C(NCC1CCC(CC1)C(O)=O)=O)Oc1ccc2C3CCCC=3C(=O)Oc2c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4658 |
| logD: | -0.0945 |
| logSw: | -2.8849 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.249 |
| InChI Key: | CIPDGAJKNINTBP-NFOMZHRRSA-N |