AG14361

CAT: 0127-BUP14322-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP14322-02Size:5 mg

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

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CAS Number

328543-09-5

Synonyms

AG 14361, AG-14361

Purity

=95%

Smiles

CN(C)Cc1ccc(cc1)-c1nc2cccc3C(=O)NCCn1c23

Chemical Information

AG-14361

LSM-1988 is a member of benzimidazoles.

CAS Number	328543-09-5
PubChem CID	9840076
IUPAC Name	2-[4-[(dimethylamino)methyl]phenyl]-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-9-one
Molecular Formula	C19H20N4O
Molecular Weight	320.4
XLogP	1.9
Topological Polar Surface Area	50.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	24
Formal Charge	0
Complexity	460

SMILES

CN(C)CC1=CC=C(C=C1)C2=NC3=CC=CC4=C3N2CCNC4=O

InChI

InChI=1S/C19H20N4O/c1-22(2)12-13-6-8-14(9-7-13)18-21-16-5-3-4-15-17(16)23(18)11-10-20-19(15)24/h3-9H,10-12H2,1-2H3,(H,20,24)

InChIKey

SEKJSSBJKFLZIT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 328543-09-5

CID: 9840076

Formula: C19H20N4O

MW: 320.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	320.4
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	320.16371127
Monoisotopic Mass	320.16371127
Topological Polar Surface Area	50.2 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	460
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
BUP12653-01	Tyrphostin AG1433