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FORX-428

CAT: 0013-GTR19277327-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19277327-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
FORX-428
CAS Number
2922789-15-7
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-(5-(difluoromethyl)-1,3,4-thiadiazol-2-yl)-8-((3S,5S)-3,5-dimethylpiperazin-1-yl)-N-(1-methylcyclopropyl)imidazo[1,5-a]pyridine-6-sulfonamide
CAS Number2922789-15-7
PubChem CID168191398
IUPAC Name3-[5-(difluoromethyl)-1,3,4-thiadiazol-2-yl]-8-[(3S,5S)-3,5-dimethylpiperazin-1-yl]-N-(1-methylcyclopropyl)imidazo[1,5-a]pyridine-6-sulfonamide
Molecular FormulaC20H25F2N7O2S2
Molecular Weight497.6
XLogP2.7
Topological Polar Surface Area141
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity818
SMILES
C[C@H]1CN(C[C@@H](N1)C)C2=CC(=CN3C2=CN=C3C4=NN=C(S4)C(F)F)S(=O)(=O)NC5(CC5)C
InChI
InChI=1S/C20H25F2N7O2S2/c1-11-8-28(9-12(2)24-11)14-6-13(33(30,31)27-20(3)4-5-20)10-29-15(14)7-23-17(29)19-26-25-18(32-19)16(21)22/h6-7,10-12,16,24,27H,4-5,8-9H2,1-3H3/t11-,12-/m0/s1
InChIKey
YGEYQBHHQVNSHP-RYUDHWBXSA-N
Chemical Structure
2D Structure
2D structure of 3-(5-(difluoromethyl)-1,3,4-thiadiazol-2-yl)-8-((3S,5S)-3,5-dimethylpiperazin-1-yl)-N-(1-methylcyclopropyl)imidazo[1,5-a]pyridine-6-sulfonamide
CAS: 2922789-15-7
CID: 168191398
Formula: C20H25F2N7O2S2
MW: 497.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight497.6
XLogP32.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass497.14792174
Monoisotopic Mass497.14792174
Topological Polar Surface Area141 Ų
Heavy Atom Count33
Formal Charge0
Complexity818
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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