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Tipepidine hydrochloride 5mg

CAT: 0628-A21908-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A21908-5Size:5 mg
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CAS Number
1449686-84-3

Chemical Information

Tipepidine hydrochloride
CAS Number1449686-84-3
PubChem CID138991192
IUPAC Name3-(dithiophen-2-ylmethylidene)-1-methylpiperidine;hydrochloride
Molecular FormulaC15H18ClNS2
Molecular Weight311.9
Topological Polar Surface Area59.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity308
SMILES
CN1CCCC(=C(C2=CC=CS2)C3=CC=CS3)C1.Cl
InChI
InChI=1S/C15H17NS2.ClH/c1-16-8-2-5-12(11-16)15(13-6-3-9-17-13)14-7-4-10-18-14;/h3-4,6-7,9-10H,2,5,8,11H2,1H3;1H
InChIKey
MICLPSFJJVIDJE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tipepidine hydrochloride
CAS: 1449686-84-3
CID: 138991192
Formula: C15H18ClNS2
MW: 311.9
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass311.0569196
Monoisotopic Mass311.0569196
Topological Polar Surface Area59.7 Ų
Heavy Atom Count19
Formal Charge0
Complexity308
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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