Tirofiban Impurity 90

CAT: 1596-AR-T05326-01Size: 10 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-T05326-01Size:10 Units

Selected

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

Quick Request Actions

CAS Number

5421-79-4

Synonyms

4,4',4''- (propane-1,2,3-triyl) tripyridine

Molecular Formula

C18H17N3

Molecular Weight

275.35

API Name

Tirofiban

Chemical Information

4,4',4''-Propane-1,2,3-triyltripyridine

CAS Number	5421-79-4
PubChem CID	223672
IUPAC Name	4-(1,3-dipyridin-4-ylpropan-2-yl)pyridine
Molecular Formula	C18H17N3
Molecular Weight	275.3
XLogP	2.7
Topological Polar Surface Area	38.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	21
Formal Charge	0
Complexity	256

SMILES

C1=CN=CC=C1CC(CC2=CC=NC=C2)C3=CC=NC=C3

InChI

InChI=1S/C18H17N3/c1-7-19-8-2-15(1)13-18(17-5-11-21-12-6-17)14-16-3-9-20-10-4-16/h1-12,18H,13-14H2

InChIKey

JCJAOOWIIGTYEH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5421-79-4

CID: 223672

Formula: C18H17N3

MW: 275.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	275.3
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	275.142247555
Monoisotopic Mass	275.142247555
Topological Polar Surface Area	38.7 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	256
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
RM-T180699-01	Tirofiban Impurity 99; Tirofiban Impurity W
RM-T180601-01	Tirofiban Impurity A
AQD24425-01	Tirofiban impurity 8
RM-T180686-01	Tirofiban Impurity 86
RM-T180624-01	Tirofiban Impurity X
RM-T180622-01	Tirofiban Impurity V
RM-T180694-01	Tirofiban Impurity 94
RM-T180695-01	Tirofiban Impurity 95
RM-T180602-01	Tirofiban Impurity B
RM-T180607-01	Tirofiban Impurity G