Name: Name:2-[(1,1-Dimethylethyl)(Phenylmethyl)Amino]-1-[4-Hydroxy-3-(Hydroxy-Methyl)Phenyl]Ethanonesalbutamol
Brand: Angene
SKU: AG003G7I
Rating: 90 (10 reviews)

2-[(1,1-Dimethylethyl)(Phenylmethyl)Amino]-1-[4-Hydroxy-3-(Hydroxy-Methyl)Phenyl]Ethanonesalbutamol

CAS No.:

64092-10-0

Catalog Number:

AG003G7I

Molecular Formula:

C20H26ClNO3

Molecular Weight:

363.8783

Catalog Number:

AG003G7I

Chemical Name:

2-[(1,1-Dimethylethyl)(Phenylmethyl)Amino]-1-[4-Hydroxy-3-(Hydroxy-Methyl)Phenyl]Ethanonesalbutamol

CAS Number:

64092-10-0

Molecular Formula:

C20H26ClNO3

Molecular Weight:

363.8783

MDL Number:

MFCD10566698

IUPAC Name:

2-[benzyl(tert-butyl)amino]-1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanone

InChI:

InChI=1S/C20H25NO3/c1-20(2,3)21(12-15-7-5-4-6-8-15)13-19(24)16-9-10-18(23)17(11-16)14-22/h4-11,22-23H,12-14H2,1-3H3

InChI Key:

OCLIQASIQHOWRE-UHFFFAOYSA-N

SMILES:

OCc1cc(ccc1O)C(=O)CN(C(C)(C)C)Cc1ccccc1.Cl

EC Number:

613-462-9

UNII:

B2X63QT035

Complexity:

398

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.183g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.424g/mol

Monoisotopic Mass:

327.183g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5