SEN 177

CAT: 0926-BS170200-01Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0926-BS170200-01Size:25 mg

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

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CAS Number

2117405-13-5

Synonyms

6'-Fluoro-2-[4- (4-methyl-4H-1,2,4-triazol-3-yl) -1-piperidinyl]-3,3'-bipyridine; SEN177

Smiles

CN1C=NN=C1C2CCN (CC2) C3=C (C=CC=N3) C4=CN=C (C=C4) F

Molecular Formula

C18H19FN6

Molecular Weight

338.38 g/mol

Controlled

Chemical Information

3-(6-fluoropyridin-3-yl)-2-(4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl)pyridine

SEN177 is a member of bipyridines.

CAS Number	2117405-13-5
PubChem CID	91618245
IUPAC Name	2-fluoro-5-[2-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-3-pyridinyl]pyridine
Molecular Formula	C18H19FN6
Molecular Weight	338.4
XLogP	2.1
Topological Polar Surface Area	59.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	25
Formal Charge	0
Complexity	430

SMILES

CN1C=NN=C1C2CCN(CC2)C3=C(C=CC=N3)C4=CN=C(C=C4)F

InChI

InChI=1S/C18H19FN6/c1-24-12-22-23-17(24)13-6-9-25(10-7-13)18-15(3-2-8-20-18)14-4-5-16(19)21-11-14/h2-5,8,11-13H,6-7,9-10H2,1H3

InChIKey

AJIAMIPUWJQSPR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2117405-13-5

CID: 91618245

Formula: C18H19FN6

MW: 338.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	338.4
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	338.16552279
Monoisotopic Mass	338.16552279
Topological Polar Surface Area	59.7 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	430
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	1
Compound Is Canonicalized	Yes

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