DACA

CAT: 0607-BA4556-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA4556-50Size:50 mg

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CAS Number

89459-25-6

Molecular Formula

C18H19N3O

Molecular Weight

293.36

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

N-(2-(Dimethylamino)ethyl)acridine-4-carboxamide

Acridine Carboxamide has been used in trials studying the treatment of Lung Cancer and Brain and Central Nervous System Tumors.

CAS Number	89459-25-6
PubChem CID	107805
IUPAC Name	N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
Molecular Formula	C18H19N3O
Molecular Weight	293.4
XLogP	3.3
Topological Polar Surface Area	45.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	385

SMILES

CN(C)CCNC(=O)C1=CC=CC2=CC3=CC=CC=C3N=C21

InChI

InChI=1S/C18H19N3O/c1-21(2)11-10-19-18(22)15-8-5-7-14-12-13-6-3-4-9-16(13)20-17(14)15/h3-9,12H,10-11H2,1-2H3,(H,19,22)

InChIKey

XBGNERSKEKDZDS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 89459-25-6

CID: 107805

Formula: C18H19N3O

MW: 293.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	293.4
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	293.152812238
Monoisotopic Mass	293.152812238
Topological Polar Surface Area	45.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	385
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
C8396-1	DACM