Dimebolin

CAT: 0127-BUP07232-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP07232-01Size:5 mg

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CAS Number

3613-73-8

Synonyms

Latrepirdine, Dimebon, Dimebone

Purity

=98%

Smiles

CN1CCc2c(C1)c1cc(C)ccc1n2CCc1ccc(C)nc1

Chemical Information

Latrepirdine

Latrepirdine is a member of methylpyridines and a pyridoindole. It has a role as a geroprotector.

CAS Number	3613-73-8
PubChem CID	197033
IUPAC Name	2,8-dimethyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indole
Molecular Formula	C21H25N3
Molecular Weight	319.4
XLogP	3.5
Topological Polar Surface Area	21.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	24
Formal Charge	0
Complexity	425

SMILES

CC1=CC2=C(C=C1)N(C3=C2CN(CC3)C)CCC4=CN=C(C=C4)C

InChI

InChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3

InChIKey

JNODQFNWMXFMEV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3613-73-8

CID: 197033

Formula: C21H25N3

MW: 319.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	319.4
XLogP3	3.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	319.204847810
Monoisotopic Mass	319.204847810
Topological Polar Surface Area	21.1 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	425
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
MBS3616013-01	Dimebolin
sc-294348A	Dimebolin dihydrochloride