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101249-88-1 | Glycinamide, 1-[(1,1-dimethylethoxy)carbonyl]-L-prolyl-L-arginyl- (9CI)
CAS No: 101249-88-1 Catalog No: AG00041P MDL No:
Product Description
Catalog Number:
AG00041P
Chemical Name:
Glycinamide, 1-[(1,1-dimethylethoxy)carbonyl]-L-prolyl-L-arginyl- (9CI)
CAS Number:
101249-88-1
Molecular Formula:
C18H33N7O5
Molecular Weight:
427.4985
IUPAC Name:
tert-butyl 2-[[1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate
InChI:
InChI=1S/C18H33N7O5/c1-18(2,3)30-17(29)25-9-5-7-12(25)15(28)24-11(6-4-8-22-16(20)21)14(27)23-10-13(19)26/h11-12H,4-10H2,1-3H3,(H2,19,26)(H,23,27)(H,24,28)(H4,20,21,22)
InChI Key:
ILZRNOORCXZNOM-UHFFFAOYSA-N
SMILES:
NC(=N)NCCC[C@@H](C(=O)NCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C
Properties
Complexity:
670
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.254g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
427.506g/mol
Monoisotopic Mass:
427.254g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
195A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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