Name: Name:tert-Butyl 4-(2-(4-((methylsulfonyl)oxy)piperidin-1-yl)-2-oxoethyl)piperidine-1-carboxylate
Brand: Angene
SKU: AG00E5X8
Rating: 90 (10 reviews)

tert-Butyl 4-(2-(4-((methylsulfonyl)oxy)piperidin-1-yl)-2-oxoethyl)piperidine-1-carboxylate

CAS No.:

440634-25-3

Catalog Number:

AG00E5X8

Molecular Formula:

C18H32N2O6S

Molecular Weight:

404.5215

Catalog Number:

AG00E5X8

Chemical Name:

tert-Butyl 4-(2-(4-((methylsulfonyl)oxy)piperidin-1-yl)-2-oxoethyl)piperidine-1-carboxylate

CAS Number:

440634-25-3

Molecular Formula:

C18H32N2O6S

Molecular Weight:

404.5215

MDL Number:

MFCD07778436

IUPAC Name:

tert-butyl 4-[2-(4-methylsulfonyloxypiperidin-1-yl)-2-oxoethyl]piperidine-1-carboxylate

InChI:

InChI=1S/C18H32N2O6S/c1-18(2,3)25-17(22)20-9-5-14(6-10-20)13-16(21)19-11-7-15(8-12-19)26-27(4,23)24/h14-15H,5-13H2,1-4H3

InChI Key:

HCPHGCCJTBULLI-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(CC1)OS(=O)(=O)C)CC1CCN(CC1)C(=O)OC(C)(C)C

EC Number:

610-165-6

Complexity:

621

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

404.198g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

404.522g/mol

Monoisotopic Mass:

404.198g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

102A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3