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219511-68-9 | Ethyl (S)-4-[(3-Boc-guanidino)oxy]-2-(Boc-amino)butanoate
CAS No: 219511-68-9 Catalog No: AG01FLI6 MDL No:
Product Description
Catalog Number:
AG01FLI6
Chemical Name:
Ethyl (S)-4-[(3-Boc-guanidino)oxy]-2-(Boc-amino)butanoate
CAS Number:
219511-68-9
IUPAC Name:
ethyl 4-[[amino-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]amino]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
InChI:
InChI=1S/C17H32N4O7/c1-8-25-12(22)11(19-14(23)27-16(2,3)4)9-10-26-21-13(18)20-15(24)28-17(5,6)7/h11H,8-10H2,1-7H3,(H,19,23)(H3,18,20,21,24)
InChI Key:
PZMJOLYZNPGTKT-UHFFFAOYSA-N
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.227g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
404.464g/mol
Monoisotopic Mass:
404.227g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
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