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Carfilzomib Impurity 28

CAT: 1596-AR-C06224-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C06224-01Size:10 Units
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CAS Number
143415-51-4
Synonyms
(S) -2- ((Tert-butoxycarbonyl) amino) -4-cyclohexylbutanoic acid
Molecular Formula
C15H27NO4
Molecular Weight
285.38
API Name
Carfilzomib

Chemical Information

(2S)-2-(((tert-butoxy)carbonyl)amino)-4-cyclohexylbutanoic acid
CAS Number143415-51-4
PubChem CID22862476
IUPAC Name(2S)-4-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Molecular FormulaC15H27NO4
Molecular Weight285.38
XLogP4
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity329
SMILES
CC(C)(C)OC(=O)N[C@@H](CCC1CCCCC1)C(=O)O
InChI
InChI=1S/C15H27NO4/c1-15(2,3)20-14(19)16-12(13(17)18)10-9-11-7-5-4-6-8-11/h11-12H,4-10H2,1-3H3,(H,16,19)(H,17,18)/t12-/m0/s1
InChIKey
CMORIBDLPGOGNO-LBPRGKRZSA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-(((tert-butoxy)carbonyl)amino)-4-cyclohexylbutanoic acid
CAS: 143415-51-4
CID: 22862476
Formula: C15H27NO4
MW: 285.38
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight285.38
XLogP34
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass285.19400834
Monoisotopic Mass285.19400834
Topological Polar Surface Area75.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity329
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes