ORY1001

CAT: 0127-BUP07565-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP07565-02Size:10 mg

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

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CAS Number

1431326-61-2

Synonyms

RG-6016, ORY-1001 (RG-6016) 2HCl, ORY-1001, ORY 1001

Purity

=98%

Smiles

Cl.Cl.NC1CCC(CC1)N[C@@H]1C[C@H]1c1ccccc1

Chemical Information

Iadademstat dihydrochloride

CAS Number	1431326-61-2
PubChem CID	71664305
IUPAC Name	4-N-[(1R,2S)-2-phenylcyclopropyl]cyclohexane-1,4-diamine;dihydrochloride
Molecular Formula	C15H24Cl2N2
Molecular Weight	303.3
Topological Polar Surface Area	38.1
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	19
Formal Charge	0
Complexity	239

SMILES

C1CC(CCC1N)N[C@@H]2C[C@H]2C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C15H22N2.2ClH/c16-12-6-8-13(9-7-12)17-15-10-14(15)11-4-2-1-3-5-11;;/h1-5,12-15,17H,6-10,16H2;2*1H/t12?,13?,14-,15+;;/m0../s1

InChIKey

UCINOBZMLCREGM-RNNUGBGQSA-N

Chemical Structure

2D Structure

CAS: 1431326-61-2

CID: 71664305

Formula: C15H24Cl2N2

MW: 303.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	303.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	302.1316542
Monoisotopic Mass	302.1316542
Topological Polar Surface Area	38.1 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	239
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

Catalog	Name
T6922-01	ORY1001
558251	ORY1001 HCl