SRPIN340

CAT: 0127-BUP12948-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP12948-02Size:10 mg

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

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CAS Number

218156-96-8

Synonyms

SRPK inhibitor

Purity

=98%

Smiles

FC(F)(F)c1ccc(N2CCCCC2)c(NC(=O)c2ccncc2)c1

Chemical Information

Srpin340

Serine-Arginine-Rich Protein Kinase Inhibitor

CAS Number	218156-96-8
PubChem CID	2797577
IUPAC Name	N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide
Molecular Formula	C18H18F3N3O
Molecular Weight	349.3
XLogP	3.5
Topological Polar Surface Area	45.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Heavy Atom Count	25
Formal Charge	0
Complexity	445

SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H18F3N3O/c19-18(20,21)14-4-5-16(24-10-2-1-3-11-24)15(12-14)23-17(25)13-6-8-22-9-7-13/h4-9,12H,1-3,10-11H2,(H,23,25)

InChIKey

DWFGGOFPIISJIT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 218156-96-8

CID: 2797577

Formula: C18H18F3N3O

MW: 349.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	349.3
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	3
Exact Mass	349.14019669
Monoisotopic Mass	349.14019669
Topological Polar Surface Area	45.2 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	445
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

Catalog	Name
B2032-5	SRPIN340