COX/5-LO-IN-1

CAT: 0931-T13263-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T13263-01Size:25 mg

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

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CAS Number

154355-75-6

Target

COX, Lipoxygenase

Related Pathways

Metabolism, Immunology/Inflammation, Neuroscience

Bioactivity

COX/5-LO-IN-1 is a cyclooxygenase and 5-lipoxygenase (5-LO) inhibitor, and used for inflammatory and allergic disease states.

Smiles

C(C=1SC(C#CC(N(C(N)=O)O)C)=CC1)C2=CC=C(F)C=C2

Molecular Formula

C16H15FN2O2S

Molecular Weight

318.37

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Cox/5-LO-IN-1

CAS Number	154355-75-6
PubChem CID	9883481
IUPAC Name	1-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]-1-hydroxyurea
Molecular Formula	C16H15FN2O2S
Molecular Weight	318.4
XLogP	2.7
Topological Polar Surface Area	94.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	454

SMILES

CC(C#CC1=CC=C(S1)CC2=CC=C(C=C2)F)N(C(=O)N)O

InChI

InChI=1S/C16H15FN2O2S/c1-11(19(21)16(18)20)2-7-14-8-9-15(22-14)10-12-3-5-13(17)6-4-12/h3-6,8-9,11,21H,10H2,1H3,(H2,18,20)

InChIKey

MMSNEKOTSJRTRI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 154355-75-6

CID: 9883481

Formula: C16H15FN2O2S

MW: 318.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	318.4
XLogP3	2.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	318.08382706
Monoisotopic Mass	318.08382706
Topological Polar Surface Area	94.8 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	454
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T79594-01	COX-1/2-IN-5
T60630-01	COX/5-LOX-IN-1
T61674-01	COX-2/5-LOX-IN-1
T86080-01	COX-1-IN-1
T204643-01	Cox B-IN-1
T60403-01	COX-2/NO-IN-1
T10033-01	COX-2-IN-1
T200220-01	COX-1-IN-2
T61196-01	COX-1/2-IN-1
T86081-01	COX-2/15-LOX-IN-5

Alternative Products

Catalog	Name
HY-U00347	COX/5-LO-IN-1
GTR19274811-01	COX-1-IN-5
HY-126898-01	5-LO/mPGES1-IN-1
303914-01	5-LO
MBS5821256	COX-1/2-IN-5
MBS5803354	COX/5-LOX-IN-1
052958	5-LO (5-Lipoxygenase)
sc-518175	5-LO (A-9)
B0769-01	5-LO Antibody
341629-01	5-LO discontinued

COX/5-LO-IN-1

Chemical Information

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