Descarbonyl Avibactam

CAT: 1596-AR-A07678-01Size: 10 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-A07678-01Size:10 Units

Selected

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

Quick Request Actions

CAS Number

2243810-78-6

Synonyms

((((3R,6S) -6-carbamoylpiperidin-3-yl) amino) oxy) sulfonic acid

Molecular Formula

C6H13N3O5S

Molecular Weight

239.2

API Name

Avibactam

Chemical Information

Descarbonyl avibactam

CAS Number	2243810-78-6
PubChem CID	58319023
IUPAC Name	[[(3R,6S)-6-carbamoylpiperidin-3-yl]amino] hydrogen sulfate
Molecular Formula	C6H13N3O5S
Molecular Weight	239.25
XLogP	-4.3
Topological Polar Surface Area	139
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	15
Formal Charge	0
Complexity	324

SMILES

C1C[C@H](NC[C@@H]1NOS(=O)(=O)O)C(=O)N

InChI

InChI=1S/C6H13N3O5S/c7-6(10)5-2-1-4(3-8-5)9-14-15(11,12)13/h4-5,8-9H,1-3H2,(H2,7,10)(H,11,12,13)/t4-,5+/m1/s1

InChIKey

LGZAYOAHVMFJSW-UHNVWZDZSA-N

Chemical Structure

2D Structure

CAS: 2243810-78-6

CID: 58319023

Formula: C6H13N3O5S

MW: 239.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	239.25
XLogP3	-4.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	239.05759170
Monoisotopic Mass	239.05759170
Topological Polar Surface Area	139 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	324
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-A02989-01	Avibactam Descarbonyl Impurity Na Salt
AR-R01791-01	Rivaroxaban Descarbonyl Impurity
AR-R01809-01	Rivaroxaban Phthalimido Descarbonyl Impurity
AR-R09975-01	(2RS) -Rivaroxaban Descarbonyl Impurity
AR-R09831-01	Rivaroxaban Descarbonyl Open-Ring Impurity
AR-L05919-01	Linezolid Descarbonyl N-Desacetyl Impurity
AR-I08242-01	(R) -Linezolid Desacetamide Descarbonyl Phthalimide
AR-A02994-01	Avibactam Impurity 6
AR-A03005-01	Avibactam Impurity 17
AR-A07680-01	Avibactam Impurity 1

Catalog	Name
TPD81078-01	Avibactam descarbonyl
TRC-A795110-100MG	Avibactam Descarbonyl Sodium
CS-O-62717	N-Nitroso Avibactam Descarbonyl impurity
CS-O-62722	N-Nitroso Avibactam Descarbonyl Impurity-1
T84986-01	Descarbonyl Lacosamide
RM-L142607-01	Linezolid Descarbonyl Impurity
A3205-50	Avibactam
460134-01	N, O-Descarbonyl Tedizolid
RM-L142610-01	Linezolid Desacetamide Descarbonyl Phthalimide
TRC-D282070-1G	N,O-Descarbonyl Tedizolid