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(Rac) -Norcisapride

CAT: 0127-BUP03973-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP03973-01Size:5 mg
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CAS Number
84946-16-7
Purity
=98%
Smiles
C(NC1C(OC)CNCC1)(=O)C2=C(OC)C=C(N)C(Cl)=C2

Chemical Information

Norcisapride

Norcisapride is a member of benzamides.

CAS Number84946-16-7
PubChem CID3019427
IUPAC Name4-amino-5-chloro-2-methoxy-N-(3-methoxypiperidin-4-yl)benzamide
Molecular FormulaC14H20ClN3O3
Molecular Weight313.78
XLogP0.8
Topological Polar Surface Area85.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity358
SMILES
COC1CNCCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl
InChI
InChI=1S/C14H20ClN3O3/c1-20-12-6-10(16)9(15)5-8(12)14(19)18-11-3-4-17-7-13(11)21-2/h5-6,11,13,17H,3-4,7,16H2,1-2H3,(H,18,19)
InChIKey
OMLDMGPCWMBPAN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Norcisapride
CAS: 84946-16-7
CID: 3019427
Formula: C14H20ClN3O3
MW: 313.78
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight313.78
XLogP30.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass313.1193192
Monoisotopic Mass313.1193192
Topological Polar Surface Area85.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity358
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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