YM 212

CAT: 0013-GTR19192256Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19192256Size:25 mg

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Description

YM 212 is a small molecule biochemical compound utilized in research. It is employed in both in vitro and in vivo studies to investigate biological pathways, particularly within the fields of cell signaling and neuroscience.

CAS Number

107831-14-1

Smiles

O=C (O) C (C) (C) CCCCOC1=CC=C (OCCCCCN2C=NC=C2) C=C1

Molecular Formula

C22H32N2O4

Molecular Weight

388.5

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

YM 212

structure given in first source

CAS Number	107831-14-1
PubChem CID	129980
IUPAC Name	6-[4-(5-imidazol-1-ylpentoxy)phenoxy]-2,2-dimethylhexanoic acid
Molecular Formula	C22H32N2O4
Molecular Weight	388.5
XLogP	4.2
Topological Polar Surface Area	73.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	14
Heavy Atom Count	28
Formal Charge	0
Complexity	436

SMILES

CC(C)(CCCCOC1=CC=C(C=C1)OCCCCCN2C=CN=C2)C(=O)O

InChI

InChI=1S/C22H32N2O4/c1-22(2,21(25)26)12-4-7-17-28-20-10-8-19(9-11-20)27-16-6-3-5-14-24-15-13-23-18-24/h8-11,13,15,18H,3-7,12,14,16-17H2,1-2H3,(H,25,26)

InChIKey

RWACOJASAIEHOK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 107831-14-1

CID: 129980

Formula: C22H32N2O4

MW: 388.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	388.5
XLogP3	4.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	14
Exact Mass	388.23620751
Monoisotopic Mass	388.23620751
Topological Polar Surface Area	73.6 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	436
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

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YM 212

Chemical Information

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