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Isomer-GAT 107

CAT: 1410-M34265-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Isomer-GAT 107 ((-) GAT 107) is an inactive isomer of (+) GAT 107.
CAS Number
1426240-47-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
405.31
Molecular Formula
C18H17BrN2O2S
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

isomer-GAT 107
CAS Number1426240-47-2
PubChem CID7441887
IUPAC Name(3aS,4R,9bR)-4-(4-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
Molecular FormulaC18H17BrN2O2S
Molecular Weight405.3
XLogP3.6
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity595
SMILES
C1C=C[C@@H]2[C@H]1[C@@H](NC3=C2C=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)Br
InChI
InChI=1S/C18H17BrN2O2S/c19-12-6-4-11(5-7-12)18-15-3-1-2-14(15)16-10-13(24(20,22)23)8-9-17(16)21-18/h1-2,4-10,14-15,18,21H,3H2,(H2,20,22,23)/t14-,15+,18+/m1/s1
InChIKey
YNCXHXYZTLIZTO-VKJFTORMSA-N
Chemical Structure
2D Structure
2D structure of isomer-GAT 107
CAS: 1426240-47-2
CID: 7441887
Formula: C18H17BrN2O2S
MW: 405.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight405.3
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass404.01941
Monoisotopic Mass404.01941
Topological Polar Surface Area80.6 Ų
Heavy Atom Count24
Formal Charge0
Complexity595
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5802386isomer-GAT 107
RA24459GAT-2
MBS3602537-01GAT-100
MBS3600132-01GAT-211
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GTR18221593GAT-2 Antibody
R30811GAT-1 Antibody
MBS555598-01GAT-2, Antiserum, Rabbit
9169Gatifloxacin GAT 5 µg
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