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N 563

CAS No.:
140686-92-6
Catalog Number:
AG009CN9
Molecular Formula:
C15H29N5O5
Molecular Weight:
359.4213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$300
- +
10mg
98%
1 week
United States
$466
- +
50mg
98%
1 week
United States
$1279
- +
100mg
98%
1 week
United States
$2140
- +
Product Description
Catalog Number:
AG009CN9
Chemical Name:
N 563
CAS Number:
140686-92-6
Molecular Formula:
C15H29N5O5
Molecular Weight:
359.4213
MDL Number:
MFCD00909426
IUPAC Name:
3-[[4-[7-(diaminomethylideneamino)heptanoylamino]-3-hydroxybutanoyl]amino]propanoic acid
InChI:
InChI=1S/C15H29N5O5/c16-15(17)19-7-4-2-1-3-5-12(22)20-10-11(21)9-13(23)18-8-6-14(24)25/h11,21H,1-10H2,(H,18,23)(H,20,22)(H,24,25)(H4,16,17,19)
InChI Key:
IFBKFXWWJPFRDV-UHFFFAOYSA-N
SMILES:
OC(CC(=O)NCCC(=O)O)CNC(=O)CCCCCCNC(=N)N
Properties
Complexity:
452  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.217g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
359.427g/mol
Monoisotopic Mass:
359.217g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
180A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3  
Properties