Name: Name:4-[4-Fluoro-2-(phenylmethoxy)phenyl]-α-methyl-2,6-bis(1-methylethyl)-5-(1-propen-1-yl)-3-Pyridinemethanol
Brand: Angene
SKU: AG00DB67
Rating: 90 (10 reviews)

4-[4-Fluoro-2-(phenylmethoxy)phenyl]-α-methyl-2,6-bis(1-methylethyl)-5-(1-propen-1-yl)-3-Pyridinemethanol

CAS No.:

503559-84-0

Catalog Number:

AG00DB67

Molecular Formula:

C29H34FNO2

Molecular Weight:

447.5842

Catalog Number:

AG00DB67

Chemical Name:

4-[4-Fluoro-2-(phenylmethoxy)phenyl]-α-methyl-2,6-bis(1-methylethyl)-5-(1-propen-1-yl)-3-Pyridinemethanol

CAS Number:

503559-84-0

Molecular Formula:

C29H34FNO2

Molecular Weight:

447.5842

MDL Number:

MFCD14636506

IUPAC Name:

1-[4-(4-fluoro-2-phenylmethoxyphenyl)-2,6-di(propan-2-yl)-5-[(E)-prop-1-enyl]pyridin-3-yl]ethanol

InChI:

InChI=1S/C29H34FNO2/c1-7-11-24-27(26(20(6)32)29(19(4)5)31-28(24)18(2)3)23-15-14-22(30)16-25(23)33-17-21-12-9-8-10-13-21/h7-16,18-20,32H,17H2,1-6H3/b11-7+

InChI Key:

HERVQUFQZXZOBU-YRNVUSSQSA-N

SMILES:

C/C=C/c1c(nc(c(c1c1ccc(cc1OCc1ccccc1)F)C(O)C)C(C)C)C(C)C

Complexity:

602

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

447.257g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

447.594g/mol

Monoisotopic Mass:

447.257g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.9