Caroverine

CAT: 0926-FC170109-01Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0926-FC170109-01Size:2 mg

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CAS Number

23465-76-1

Smiles

CCN (CC) CCN1C2=CC=CC=C2N=C (C1=O) CC3=CC=C (C=C3) OC

Molecular Formula

C22H27N3O2

Molecular Weight

365.47 g/mol

Controlled

Chemical Information

Caroverine

Caroverine is a quinoxaline derivative.

CAS Number	23465-76-1
PubChem CID	65709
IUPAC Name	1-[2-(diethylamino)ethyl]-3-[(4-methoxyphenyl)methyl]quinoxalin-2-one
Molecular Formula	C22H27N3O2
Molecular Weight	365.5
XLogP	3.2
Topological Polar Surface Area	45.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Heavy Atom Count	27
Formal Charge	0
Complexity	510

SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C(C1=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O2/c1-4-24(5-2)14-15-25-21-9-7-6-8-19(21)23-20(22(25)26)16-17-10-12-18(27-3)13-11-17/h6-13H,4-5,14-16H2,1-3H3

InChIKey

MSPRUJDUTKRMLM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 23465-76-1

CID: 65709

Formula: C22H27N3O2

MW: 365.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	365.5
XLogP3	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	8
Exact Mass	365.21032711
Monoisotopic Mass	365.21032711
Topological Polar Surface Area	45.1 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	510
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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
T9133L-01	Caroverine
AR-C01514-01	Caroverine HCl
GTR19165776-01	Caroverine hydrochloride
HY-106467B-01	Caroverine (hydrochloride)
A22495-100	Caroverine HCl 100mg
A22495-25	Caroverine HCl 25mg
A22495-10	Caroverine HCl 10mg
HY-106467BR	Caroverine (hydrochloride) (Standard)
A22495-50	Caroverine HCl 50mg
A22495-5	Caroverine HCl 5mg