Name: Name:1-Piperidinecarboxylic acid, 4-[2-hydroxy-1-(2-phenyl-1H-benziMidazol-1-yl)ethyl]-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00ABH1
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-[2-hydroxy-1-(2-phenyl-1H-benziMidazol-1-yl)ethyl]-, 1,1-diMethylethyl ester

CAS No.:

1440753-74-1

Catalog Number:

AG00ABH1

Molecular Formula:

C25H31N3O3

Molecular Weight:

421.5319

Catalog Number:

AG00ABH1

Chemical Name:

1-Piperidinecarboxylic acid, 4-[2-hydroxy-1-(2-phenyl-1H-benziMidazol-1-yl)ethyl]-, 1,1-diMethylethyl ester

CAS Number:

1440753-74-1

Molecular Formula:

C25H31N3O3

Molecular Weight:

421.5319

MDL Number:

MFCD28347641

IUPAC Name:

tert-butyl 4-[2-hydroxy-1-(2-phenylbenzimidazol-1-yl)ethyl]piperidine-1-carboxylate

InChI:

InChI=1S/C25H31N3O3/c1-25(2,3)31-24(30)27-15-13-18(14-16-27)22(17-29)28-21-12-8-7-11-20(21)26-23(28)19-9-5-4-6-10-19/h4-12,18,22,29H,13-17H2,1-3H3

InChI Key:

APLUSNCKVSWRLA-UHFFFAOYSA-N

SMILES:

OCC(n1c(nc2c1cccc2)c1ccccc1)C1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

593

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

421.237g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

421.541g/mol

Monoisotopic Mass:

421.237g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: