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1624261-89-7 | Cyclopentanecarboxylic acid, 3-[(1R)-1-(acetylamino)-2-ethylbutyl]-4-amino-2-hydroxy-, (1S,2S,3R,4R)-rel-
CAS No: 1624261-89-7 Catalog No: AG001T5Q MDL No:
Product Description
Catalog Number:
AG001T5Q
Chemical Name:
Cyclopentanecarboxylic acid, 3-[(1R)-1-(acetylamino)-2-ethylbutyl]-4-amino-2-hydroxy-, (1S,2S,3R,4R)-rel-
CAS Number:
1624261-89-7
Molecular Formula:
C14H26N2O4
Molecular Weight:
286.3672
IUPAC Name:
(1S,2S,3R,4R)-3-[(1R)-1-acetamido-2-ethylbutyl]-4-amino-2-hydroxycyclopentane-1-carboxylic acid
InChI:
InChI=1S/C14H26N2O4/c1-4-8(5-2)12(16-7(3)17)11-10(15)6-9(13(11)18)14(19)20/h8-13,18H,4-6,15H2,1-3H3,(H,16,17)(H,19,20)/t9-,10+,11+,12+,13+/m0/s1
InChI Key:
LUBKBQAAWUOYOW-ZOLYEBIHSA-N
SMILES:
CCC([C@H]([C@H]1[C@H](N)C[C@@H]([C@H]1O)C(=O)O)NC(=O)C)CC
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
286.189g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
286.372g/mol
Monoisotopic Mass:
286.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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