OXA-06 hydrochloride

CAT: 0931-T84882-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T84882-01Size:10 mg

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

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CAS Number

1825455-91-1

Target

Others, ROCK

Related Pathways

Others, Cytoskeletal Signaling, Stem Cells, Cell Cycle/Checkpoint

Bioactivity

OXA-06 hydrochloride, an ATP-competitive ROCK inhibitor, impedes anchorage-dependent growth and invasion in non-small cell lung cancer cell lines. It effectively inhibits cofilin phosphorylation without inducing apoptosis [1].

Smiles

C(NCC1=C(F)C=CC=C1)C2=CC=C(C3=C4C(NC=C4)=NC=C3)C=C2.Cl

Molecular Formula

C21H20Cl2FN3

Molecular Weight

404.31

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

OXA 06 dihydrochloride

CAS Number	1825455-91-1
PubChem CID	91691120
IUPAC Name	N-[(2-fluorophenyl)methyl]-1-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)phenyl]methanamine;dihydrochloride
Molecular Formula	C21H20Cl2FN3
Molecular Weight	404.3
Topological Polar Surface Area	40.7
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	27
Formal Charge	0
Complexity	410

SMILES

C1=CC=C(C(=C1)CNCC2=CC=C(C=C2)C3=C4C=CNC4=NC=C3)F.Cl.Cl

InChI

InChI=1S/C21H18FN3.2ClH/c22-20-4-2-1-3-17(20)14-23-13-15-5-7-16(8-6-15)18-9-11-24-21-19(18)10-12-25-21;;/h1-12,23H,13-14H2,(H,24,25);2*1H

InChIKey

ZRBCUSMZOWMVJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1825455-91-1

CID: 91691120

Formula: C21H20Cl2FN3

MW: 404.3

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	404.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	403.1018312
Monoisotopic Mass	403.1018312
Topological Polar Surface Area	40.7 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	410
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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Alternative Products

Catalog	Name
GTR19232591-01	OXA-06 hydrochloride
HY-110335-01	OXA-06 (hydrochloride)
A24487-100	OXA-06 hydrochloride 100mg
A24487-50	OXA-06 hydrochloride 50mg
A24487-10	OXA-06 hydrochloride 10mg
A24487-5	OXA-06 hydrochloride 5mg
GTR19204954-01	RG7800 hydrochloride (1449598-06-4 free base)
KHD04523-01	5-Oxa-2-azaspiro[3.6]decane hydrochloride
GDD37088-01	2-Oxa-9-azaspiro[5.5]undecane hydrochloride
VPC56918-01	7-oxa-1-azaspiro[4.4]nonane hydrochloride

OXA-06 hydrochloride

Chemical Information

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