200,000+ products from a single source!

sales@angenechem.com

Home > Amines > 139423-25-9

139423-25-9

139423-25-9 | Octanamide, N-[5-[(2-amino-1,2-dithioxoethyl)amino]-4-methylpentyl]-

CAS No: 139423-25-9 Catalog No: AG001AZU MDL No:

Product Description

Catalog Number:
AG001AZU
Chemical Name:
Octanamide, N-[5-[(2-amino-1,2-dithioxoethyl)amino]-4-methylpentyl]-
CAS Number:
139423-25-9
Molecular Formula:
C16H31N3OS2
Molecular Weight:
345.5668
IUPAC Name:
N-[5-[(2-amino-2-sulfanylideneethanethioyl)amino]-4-methylpentyl]octanamide
InChI:
InChI=1S/C16H31N3OS2/c1-3-4-5-6-7-10-14(20)18-11-8-9-13(2)12-19-16(22)15(17)21/h13H,3-12H2,1-2H3,(H2,17,21)(H,18,20)(H,19,22)
InChI Key:
SBKUIOQHQOBSOQ-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)NCCCC(CNC(=S)C(=S)N)C

Properties

Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.191g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
345.564g/mol
Monoisotopic Mass:
345.191g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

Related Products

© 2019 Angene International Limited. All rights Reserved.