CAS 182167-03-9
:(2S)-3-[4-(2,2-Dimethyl-1-oxopropoxy)phenyl]-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-yl 2,2-dimethylpropanoate
Description:
The chemical substance with the name "(2S)-3-[4-(2,2-Dimethyl-1-oxopropoxy)phenyl]-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-yl 2,2-dimethylpropanoate" and CAS number "182167-03-9" is a complex organic compound characterized by its multi-functional structure, which includes a benzopyran core, various aromatic rings, and ester functionalities. This compound features a chiral center, indicated by the (2S) designation, suggesting it may exhibit stereoisomerism, which can influence its biological activity and interactions. The presence of piperidine and ether groups suggests potential for solubility in organic solvents and possible interactions with biological systems. Its structural complexity may confer specific pharmacological properties, making it of interest in medicinal chemistry. Additionally, the presence of dimethyl and propanoyl groups may enhance lipophilicity, affecting its bioavailability and distribution in biological systems. Overall, this compound's unique structural features position it as a candidate for further investigation in drug development or other chemical applications.
Formula:C39H47NO6
InChI:InChI=1S/C39H47NO6/c1-26-32-20-19-31(45-37(42)39(5,6)7)25-33(32)46-35(34(26)27-11-17-30(18-12-27)44-36(41)38(2,3)4)28-13-15-29(16-14-28)43-24-23-40-21-9-8-10-22-40/h11-20,25,35H,8-10,21-24H2,1-7H3/t35-/m0/s1
InChI key:InChIKey=OEKMGABCSLYWOP-DHUJRADRSA-N
SMILES:CC1=C([C@@H](OC=2C1=CC=C(OC(C(C)(C)C)=O)C2)C3=CC=C(OCCN4CCCCC4)C=C3)C5=CC=C(OC(C(C)(C)C)=O)C=C5
Synonyms:- (2S)-3-[4-(2,2-Dimethyl-1-oxopropoxy)phenyl]-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-yl 2,2-dimethylpropanoate
- Propanoic acid, 2,2-dimethyl-, (2S)-3-[4-(2,2-dimethyl-1-oxopropoxy)phenyl]-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-yl ester
- Propanoic acid, 2,2-dimethyl-, 4-[7-(2,2-dimethyl-1-oxopropoxy)-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-3-yl]phenyl ester, (S)-
- EM 800
- Propanoic acid, 2,2-dimethyl-, 4-[(2S)-7-(2,2-dimethyl-1-oxopropoxy)-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-3-yl]phenyl ester
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Found 1 products.
EM-800
CAS:<p>EM-800, an ERα ligand & prodrug of EM-652, inhibits E1-stimulated ZR-75-1 tumor growth in mice.</p>Formula:C39H47NO6Color and Shape:SolidMolecular weight:625.79
