Name: Name:3-(2-Benzyloxy-Ethoxymethyl)-3-[(2,2,2-Trifluoro-Acetylamino)-Methyl]-Piperidine-1-Carboxylic Acid Tert-Butyl Ester
Brand: Angene
SKU: AG00HUCW
Rating: 90 (10 reviews)

3-(2-Benzyloxy-Ethoxymethyl)-3-[(2,2,2-Trifluoro-Acetylamino)-Methyl]-Piperidine-1-Carboxylic Acid Tert-Butyl Ester

CAS No.:

1357352-58-9

Catalog Number:

AG00HUCW

Molecular Formula:

C23H33F3N2O5

Molecular Weight:

474.5137

Catalog Number:

AG00HUCW

Chemical Name:

3-(2-Benzyloxy-Ethoxymethyl)-3-[(2,2,2-Trifluoro-Acetylamino)-Methyl]-Piperidine-1-Carboxylic Acid Tert-Butyl Ester

CAS Number:

1357352-58-9

Molecular Formula:

C23H33F3N2O5

Molecular Weight:

474.5137

MDL Number:

MFCD23726512

IUPAC Name:

tert-butyl 3-(2-phenylmethoxyethoxymethyl)-3-[[(2,2,2-trifluoroacetyl)amino]methyl]piperidine-1-carboxylate

InChI:

InChI=1S/C23H33F3N2O5/c1-21(2,3)33-20(30)28-11-7-10-22(16-28,15-27-19(29)23(24,25)26)17-32-13-12-31-14-18-8-5-4-6-9-18/h4-6,8-9H,7,10-17H2,1-3H3,(H,27,29)

InChI Key:

UOBIPJFJNMAAPI-UHFFFAOYSA-N

SMILES:

O=C(N1CCCC(C1)(COCCOCc1ccccc1)CNC(=O)C(F)(F)F)OC(C)(C)C

Complexity:

633

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

474.234g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

474.521g/mol

Monoisotopic Mass:

474.234g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

77.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3