Carfilzomib Impurity 13

CAT: 1596-AR-C06273-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C06273-01Size:10 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1396006-45-3

Synonyms

(S) -2- (2-morpholinoacetamido) -4-phenylbutanoic acid

Molecular Formula

C16H22N2O4

Molecular Weight

306.36

API Name

Carfilzomib

Chemical Information

Unii-2R4ADP62TA

CAS Number	1396006-45-3
PubChem CID	121299208
IUPAC Name	(2S)-2-[(2-morpholin-4-ylacetyl)amino]-4-phenylbutanoic acid
Molecular Formula	C16H22N2O4
Molecular Weight	306.36
XLogP	-1.1
Topological Polar Surface Area	78.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Heavy Atom Count	22
Formal Charge	0
Complexity	363

SMILES

C1COCCN1CC(=O)N[C@@H](CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H22N2O4/c19-15(12-18-8-10-22-11-9-18)17-14(16(20)21)7-6-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,19)(H,20,21)/t14-/m0/s1

InChIKey

AHNYHRJIQAYZGZ-AWEZNQCLSA-N

Chemical Structure

2D Structure

CAS: 1396006-45-3

CID: 121299208

Formula: C16H22N2O4

MW: 306.36

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	306.36
XLogP3	-1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	306.15795719
Monoisotopic Mass	306.15795719
Topological Polar Surface Area	78.9 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	363
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes