200,000+ products from a single source!
sales@angenechem.com
177971-60-7 | 1-Piperazinecarboxylic acid, 4-[2-(cyclohexylamino)-2-oxoethyl]-, 1,1-dimethylethyl ester
CAS No: 177971-60-7 Catalog No: AG0025O3 MDL No:
Product Description
Catalog Number:
AG0025O3
Chemical Name:
1-Piperazinecarboxylic acid, 4-[2-(cyclohexylamino)-2-oxoethyl]-, 1,1-dimethylethyl ester
CAS Number:
177971-60-7
Molecular Formula:
C17H31N3O3
Molecular Weight:
325.4463
IUPAC Name:
tert-butyl 4-[2-(cyclohexylamino)-2-oxoethyl]piperazine-1-carboxylate
InChI:
InChI=1S/C17H31N3O3/c1-17(2,3)23-16(22)20-11-9-19(10-12-20)13-15(21)18-14-7-5-4-6-8-14/h14H,4-13H2,1-3H3,(H,18,21)
InChI Key:
DJZDLYMUXBNSOW-UHFFFAOYSA-N
SMILES:
O=C(CN1CCN(CC1)C(=O)OC(C)(C)C)NC1CCCCC1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.237g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.453g/mol
Monoisotopic Mass:
325.237g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.