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89226-25-5 | Glycinamide, 1-[(1,1-dimethylethoxy)carbonyl]thio-L-prolyl-L-leucyl-
CAS No: 89226-25-5 Catalog No: AG0043GJ MDL No:
Product Description
Catalog Number:
AG0043GJ
Chemical Name:
Glycinamide, 1-[(1,1-dimethylethoxy)carbonyl]thio-L-prolyl-L-leucyl-
CAS Number:
89226-25-5
Molecular Formula:
C18H32N4O5S
Molecular Weight:
416.5355
IUPAC Name:
tert-butyl [2-[[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]sulfanylformate
InChI:
InChI=1S/C18H32N4O5S/c1-11(2)9-12(15(24)20-10-14(19)23)21-16(25)13-7-6-8-22(13)28-17(26)27-18(3,4)5/h11-13H,6-10H2,1-5H3,(H2,19,23)(H,20,24)(H,21,25)
InChI Key:
POURSTBHCYSGLU-UHFFFAOYSA-N
SMILES:
CC(C[C@@H](C(=O)NCC(=O)N)NC(=O)[C@@H]1CCCN1SC(=O)OC(C)(C)C)C
Properties
Complexity:
591
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.209g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
416.537g/mol
Monoisotopic Mass:
416.209g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
156A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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