200,000+ products from a single source!
sales@angenechem.com
2364-66-1 | 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-
CAS No: 2364-66-1 Catalog No: AG002NZZ MDL No:
Product Description
Catalog Number:
AG002NZZ
Chemical Name:
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-
CAS Number:
2364-66-1
IUPAC Name:
(3S)-3-hexadecanoyloxy-4-(trimethylazaniumyl)butanoate
InChI:
InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3/t21-/m0/s1
InChI Key:
XOMRRQXKHMYMOC-NRFANRHFSA-N
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
399.335g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
399.616g/mol
Monoisotopic Mass:
399.335g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
Literature
| Title | Journal |
|---|---|
| Carnitine palmitoyltransferase (CPT) modulators: a medicinal chemistry perspective on 35 years of research. | Journal of medicinal chemistry 20110512 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.