Products for Research Use Only

ICR-191 dihydrochloride

CAT: 0013-GTR19320109-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19320109-01Size:10 mg
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Description
ICR-191 enhances the binding of Cisplatin to DNA and increases cell sensitivity to Cisplatin. It significantly elevates the expression of phosphorylated H2AX (γH2AX), particularly in cells undergoing DNA replication, and is applicable in leukemia research.
CAS Number
17070-45-0
Molecular Weight
451.21
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Icr 191

Icr 191 appears as yellow crystalline or chunky solid. (NTP, 1992)

CAS Number17070-45-0
PubChem CID54606642
IUPAC NameN-(2-chloroethyl)-N'-(6-chloro-2-methoxyacridin-9-yl)propane-1,3-diamine;hydrochloride
Molecular FormulaC19H22Cl3N3O
Molecular Weight414.8
Topological Polar Surface Area46.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity401
SMILES
COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCNCCCl.Cl
InChI
InChI=1S/C19H21Cl2N3O.ClH/c1-25-14-4-6-17-16(12-14)19(23-9-2-8-22-10-7-20)15-5-3-13(21)11-18(15)24-17;/h3-6,11-12,22H,2,7-10H2,1H3,(H,23,24);1H
InChIKey
PQVLERLLNMDETJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Icr 191
CAS: 17070-45-0
CID: 54606642
Formula: C19H22Cl3N3O
MW: 414.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight414.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass413.082845
Monoisotopic Mass413.082845
Topological Polar Surface Area46.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity401
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes