CHEMBL148299
3-[4-(8-methyl-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoic acid
Also Known As: 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid|3-[4-(8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene)piperidin-1-yl]propanoic acid|4-(8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene)-1-piperidinepropanoic acid|3-(4-{13-methyl-10-oxa-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}piperidin-1-yl)propanoic acid
| Molecular Formula | C22H24N2O3 |
|---|---|
| Molecular Weight | 364.17868 g/mol |
| LogP | 3.65482 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.17868 |
| Monoisotopic Mass | 364.17868 |
| Heavy Atoms | 27 |
| Complexity | 894.18097 |
Chemical Identifiers
| CAS Number | 732224-75-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C3CCN(CC3)CCC(=O)O)C4=C(CO2)N=CC=C4 |
Product Overview
CHEMBL148299 (CAS 732224-75-8), with molecular formula C22H24N2O3 and molecular weight 364.17868 g/mol. IUPAC: 3-[4-(8-methyl-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoic acid.
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