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Elacridar Hydrochloride

CAT: 0572-TRC-E489005-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-E489005-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
143851-98-3
Synonyms
N-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-9,10-dihydro-5-methoxy-9-oxo-4-acridinecarboxamide Hydrochloride; N-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-9,10-dihydro-5-methoxy-9-oxo-4-acridinecarboxamide Monohydrochloride; GF 120918A
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
[Na+].c1ccc(cc1)CCCCP(=O)(O)CC(=O)N2[C@H](C(=O)[O-])C[C@H](C3CCCCC3)C2
Molecular Formula
C34H33N3O5•xHCl
Molecular Weight
563.64
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Elacridar Hydrochloride

See also: Elacridar (has active moiety).

CAS Number143851-98-3
PubChem CID170320
IUPAC NameN-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxo-10H-acridine-4-carboxamide;hydrochloride
Molecular FormulaC34H34ClN3O5
Molecular Weight600.1
Topological Polar Surface Area89.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count43
Formal Charge0
Complexity925
SMILES
COC1=CC=CC2=C1NC3=C(C2=O)C=CC=C3C(=O)NC4=CC=C(C=C4)CCN5CCC6=CC(=C(C=C6C5)OC)OC.Cl
InChI
InChI=1S/C34H33N3O5.ClH/c1-40-28-9-5-7-26-32(28)36-31-25(33(26)38)6-4-8-27(31)34(39)35-24-12-10-21(11-13-24)14-16-37-17-15-22-18-29(41-2)30(42-3)19-23(22)20-37;/h4-13,18-19H,14-17,20H2,1-3H3,(H,35,39)(H,36,38);1H
InChIKey
IQOJZZHRYSSFJM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Elacridar Hydrochloride
CAS: 143851-98-3
CID: 170320
Formula: C34H34ClN3O5
MW: 600.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight600.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass599.2186989
Monoisotopic Mass599.2186989
Topological Polar Surface Area89.1 Ų
Heavy Atom Count43
Formal Charge0
Complexity925
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

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Alternative Products

CatalogName
A3385-10Elacridar hydrochloride
HY-50880-01Elacridar (hydrochloride)
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A15077-100Elacridar hydrochloride 100mg
A15077-5Elacridar hydrochloride 5mg
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A15077-10Elacridar hydrochloride 10mg
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145672Elacridar hydrochloride (GF 120918, P-gp inhibitor, (N-[4-[2- (3,4-Dihydro-6,7-dimethoxy-­2 (1H) -isoquinolinyl) ethyl]phenyl]-9,10-dihydro-5-m­ethoxy-9-oxo-4-acridinecarboxamide hydrochloride)
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