Products for Research Use Only

GV2-20

CAT: 0013-GTR19200258-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200258-02Size:50 mg
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Description
GV2-20 is a potent and selective inhibitor of carbonic anhydrase II (CA II) . This small molecule is a valuable research tool for investigating CA II function in physiological and pathological processes, including its roles in glaucoma, cancer, and epilepsy, as demonstrated in both in vitro and in vivo studies.
CAS Number
346411-65-2
Field of Research
Metabolism Research
Smiles
N (CCC1=CC=CC=C1) C2=C (N (=O) =O) C=C (C (O) =O) C=C2N (=O) =O
Molecular Formula
C15H13N3O6
Molecular Weight
331.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3,5-Dinitro-4-[(2-phenylethyl)amino]benzoic acid
CAS Number346411-65-2
PubChem CID24071357
IUPAC Name3,5-dinitro-4-(2-phenylethylamino)benzoic acid
Molecular FormulaC15H13N3O6
Molecular Weight331.28
XLogP3.6
Topological Polar Surface Area141
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity445
SMILES
C1=CC=C(C=C1)CCNC2=C(C=C(C=C2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]
InChI
InChI=1S/C15H13N3O6/c19-15(20)11-8-12(17(21)22)14(13(9-11)18(23)24)16-7-6-10-4-2-1-3-5-10/h1-5,8-9,16H,6-7H2,(H,19,20)
InChIKey
XAKDDYXCEWRWEZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,5-Dinitro-4-[(2-phenylethyl)amino]benzoic acid
CAS: 346411-65-2
CID: 24071357
Formula: C15H13N3O6
MW: 331.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight331.28
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass331.08043514
Monoisotopic Mass331.08043514
Topological Polar Surface Area141 Ų
Heavy Atom Count24
Formal Charge0
Complexity445
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