ethyl 1-(3-{1-[4-(propan-2-yl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl}propanoyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-{1-[4-(propan-2-yl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl}propanoyl)piperidine-4-carboxylate
ethyl 1-(3-{1-[4-(propan-2-yl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl}propanoyl)piperidine-4-carboxylate
Compound characteristics
Compound ID: | V011-7958 |
Compound Name: | ethyl 1-(3-{1-[4-(propan-2-yl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-b]pyrrol-2-yl}propanoyl)piperidine-4-carboxylate |
Molecular Weight: | 500.64 |
Molecular Formula: | C31 H36 N2 O4 |
Smiles: | CCOC(C1CCN(CC1)C(CCc1cc2COc3ccccc3c2n1c1ccc(cc1)C(C)C)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.5053 |
logD: | 5.5053 |
logSw: | -5.4168 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.028 |
InChI Key: | DCZQAKOSGYSYCF-UHFFFAOYSA-N |