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GRL-1720

CAT: 0013-GTR19210505-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210505-02Size:50 mg
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Description
GRL-1720
CAS Number
2835511-03-8
Field of Research
Infectious Disease & Virology
Smiles
C (OC=1C=C (Cl) C=NC1) (=O) C2=C3C (NCC3) =CC=C2
Molecular Formula
C14H11ClN2O2
Molecular Weight
274.7
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(5-chloro-3-pyridinyl) 2,3-dihydro-1H-indole-4-carboxylate
CAS Number2835511-03-8
PubChem CID156600307
IUPAC Name(5-chloro-3-pyridinyl) 2,3-dihydro-1H-indole-4-carboxylate
Molecular FormulaC14H11ClN2O2
Molecular Weight274.70
XLogP2.9
Topological Polar Surface Area51.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity339
SMILES
C1CNC2=CC=CC(=C21)C(=O)OC3=CC(=CN=C3)Cl
InChI
InChI=1S/C14H11ClN2O2/c15-9-6-10(8-16-7-9)19-14(18)12-2-1-3-13-11(12)4-5-17-13/h1-3,6-8,17H,4-5H2
InChIKey
JROSKNTUYSPHGX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (5-chloro-3-pyridinyl) 2,3-dihydro-1H-indole-4-carboxylate
CAS: 2835511-03-8
CID: 156600307
Formula: C14H11ClN2O2
MW: 274.70
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight274.70
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass274.0509053
Monoisotopic Mass274.0509053
Topological Polar Surface Area51.2 Ų
Heavy Atom Count19
Formal Charge0
Complexity339
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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