WR 1065

CAT: 0607-A4487-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0607-A4487-10Size:10 mg

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Description

P53/p21waf-1/MDM2 activator

CAS Number

14653-77-1

Product Name Alternative

2-(3-aminopropylamino)ethanethiol;dihydrochloride

Field of Research

Apoptosis p53

Purity

0.98

Form

White solid

Solubility

≥26.7 mg/mL in DMSO; insoluble in EtOH; ≥52.8 mg/mL in H2O

Smiles

C(CN)CNCCS.Cl.Cl

Molecular Formula

C5H14N2S·2HCl

Molecular Weight

207.16

Shipping Conditions

Blue ice

Storage Conditions

Desiccate at -20°C.

Chemical Information

2-(3-Aminopropylamino)ethanethiol dihydrochloride

CAS Number	14653-77-1
PubChem CID	146169
IUPAC Name	2-(3-aminopropylamino)ethanethiol;dihydrochloride
Molecular Formula	C5H16Cl2N2S
Molecular Weight	207.16
Topological Polar Surface Area	39.1
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	10
Formal Charge	0
Complexity	41

SMILES

C(CN)CNCCS.Cl.Cl

InChI

InChI=1S/C5H14N2S.2ClH/c6-2-1-3-7-4-5-8;;/h7-8H,1-6H2;2*1H

InChIKey

XDRLRDHLCIFZIW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14653-77-1

CID: 146169

Formula: C5H16Cl2N2S

MW: 207.16

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	207.16
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	206.0411251
Monoisotopic Mass	206.0411251
Topological Polar Surface Area	39.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	41.4
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	3
Compound Is Canonicalized	Yes

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