Ceftaroline Fosamil Impurity 32

CAT: 1596-AR-C06770-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C06770-01Size:10 Units

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

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CAS Number

1809412-65-4

Molecular Formula

C15H12N4O3S3

Molecular Weight

392.47

API Name

Ceftaroline fosamil

Chemical Information

Ceftaroline Impurity 10

CAS Number	1809412-65-4
PubChem CID	68807566
IUPAC Name	(6R,7R)-7-amino-8-oxo-3-[(4-pyridin-4-yl-1,3-thiazol-2-yl)sulfanyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular Formula	C15H12N4O3S3
Molecular Weight	392.5
XLogP	-1.4
Topological Polar Surface Area	188
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	611

SMILES

C1C(=C(N2[C@H](S1)[C@@H](C2=O)N)C(=O)O)SC3=NC(=CS3)C4=CC=NC=C4

InChI

InChI=1S/C15H12N4O3S3/c16-10-12(20)19-11(14(21)22)9(6-23-13(10)19)25-15-18-8(5-24-15)7-1-3-17-4-2-7/h1-5,10,13H,6,16H2,(H,21,22)/t10-,13-/m1/s1

InChIKey

BPYGHTNNEALZFP-ZWNOBZJWSA-N

Chemical Structure

2D Structure

CAS: 1809412-65-4

CID: 68807566

Formula: C15H12N4O3S3

MW: 392.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	392.5
XLogP3	-1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	4
Exact Mass	392.00715378
Monoisotopic Mass	392.00715378
Topological Polar Surface Area	188 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	611
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-Z00978-01	Ceftaroline Fosamil Impurity
AR-C02046-01	Ceftaroline Fosamil Impurity 16
AR-C02044-01	Ceftaroline Fosamil Impurity 14
AR-C02043-01	Ceftaroline Fosamil Impurity 13
AR-C02042-01	Ceftaroline Fosamil Impurity 12
AR-C06769-01	Ceftaroline Fosamil Impurity 31
AR-C06777-01	Ceftaroline Fosamil Impurity 25 and Ceftaroline Fosamil Impurity 26 (Equilibrium Form)
AR-C02038-01	Ceftaroline Fosamil Impurity 8
AR-C02052-01	Ceftaroline Fosamil Impurity 21
AR-C02048-01	Ceftaroline Fosamil Impurity 18

Catalog	Name
RM-C061901-01	Ceftaroline Fosamil Impurity A
RM-C061922-01	Ceftaroline Fosamil Impurity 12
RM-C061921-01	Ceftaroline Fosamil Impurity 11
RM-C061914-01	Ceftaroline Fosamil Impurity 4
RM-C061927-01	Ceftaroline Fosamil Impurity 17
RM-C061916-01	Ceftaroline Fosamil Impurity 6
RM-C061905-01	Ceftaroline Fosamil Impurity E
RM-C061908-01	Ceftaroline Fosamil Impurity H
RM-C061909-01	Ceftaroline Fosamil Impurity I
RM-C061928-01	Ceftaroline Fosamil Impurity 18