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126530-17-4 | L-Argininamide, N-acetyl-L-tyrosyl-
CAS No: 126530-17-4 Catalog No: AG000SW8 MDL No:
Product Description
Catalog Number:
AG000SW8
Chemical Name:
L-Argininamide, N-acetyl-L-tyrosyl-
CAS Number:
126530-17-4
Molecular Formula:
C17H26N6O4
Molecular Weight:
378.4261
IUPAC Name:
2-[[2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-5-(diaminomethylideneamino)pentanamide
InChI:
InChI=1S/C17H26N6O4/c1-10(24)22-14(9-11-4-6-12(25)7-5-11)16(27)23-13(15(18)26)3-2-8-21-17(19)20/h4-7,13-14,25H,2-3,8-9H2,1H3,(H2,18,26)(H,22,24)(H,23,27)(H4,19,20,21)
InChI Key:
LPDXVAAOONLYKW-UHFFFAOYSA-N
SMILES:
NC(=N)NCCC[C@@H](C(=O)N)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.202g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
378.433g/mol
Monoisotopic Mass:
378.202g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
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