Meropenem Impurity 8

CAT: 1596-AR-M04224-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M04224-02Size:25 Units

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

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CAS Number

96035-23-3

Molecular Formula

C15H19N3O5S

Molecular Weight

353.39

API Name

Meropenem

Chemical Information

Meropenem Impurity 3

CAS Number	96035-23-3
PubChem CID	13504329
IUPAC Name	(4-nitrophenyl)methyl (2R,4R)-2-(dimethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate
Molecular Formula	C15H19N3O5S
Molecular Weight	353.4
XLogP	1.5
Topological Polar Surface Area	96.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	488

SMILES

CN(C)C(=O)[C@H]1C[C@H](CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S

InChI

InChI=1S/C15H19N3O5S/c1-16(2)14(19)13-7-12(24)8-17(13)15(20)23-9-10-3-5-11(6-4-10)18(21)22/h3-6,12-13,24H,7-9H2,1-2H3/t12-,13-/m1/s1

InChIKey

VGLBNJWGUYQZHD-CHWSQXEVSA-N

Chemical Structure

2D Structure

CAS: 96035-23-3

CID: 13504329

Formula: C15H19N3O5S

MW: 353.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	353.4
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	353.10454189
Monoisotopic Mass	353.10454189
Topological Polar Surface Area	96.7 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	488
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