Alvameline 1mg

CAT: 0628-A19271-1Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0628-A19271-1Size:1 mg

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CAS Number

120241-31-8

Chemical Information

Alvameline

Alvameline is a dihydropyridine.

CAS Number	120241-31-8
PubChem CID	178030
IUPAC Name	5-(2-ethyltetrazol-5-yl)-1-methyl-3,6-dihydro-2H-pyridine
Molecular Formula	C9H15N5
Molecular Weight	193.25
XLogP	0.7
Topological Polar Surface Area	46.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	227

SMILES

CCN1N=C(N=N1)C2=CCCN(C2)C

InChI

InChI=1S/C9H15N5/c1-3-14-11-9(10-12-14)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3

InChIKey

RNMOMKCRCIRYCZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 120241-31-8

CID: 178030

Formula: C9H15N5

MW: 193.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	193.25
XLogP3	0.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	193.13274550
Monoisotopic Mass	193.13274550
Topological Polar Surface Area	46.8 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	227
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