Products for Research Use Only

BT18

CAT: 1410-M24975-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M24975-01Size:5 mg
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Description
BT18 is a mimic with function similar to glial cell line-derived neurotrophic factor (GDNF) .
CAS Number
924811-53-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
637.64
Molecular Formula
C30H31F4N3O6S
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

[4-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methoxyphenyl]piperazin-1-yl]-[4-fluoro-2-(trifluoromethyl)phenyl]methanone
CAS Number924811-53-0
PubChem CID46088742
IUPAC Name[4-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methoxyphenyl]piperazin-1-yl]-[4-fluoro-2-(trifluoromethyl)phenyl]methanone
Molecular FormulaC30H31F4N3O6S
Molecular Weight637.6
XLogP4.5
Topological Polar Surface Area97
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Heavy Atom Count44
Formal Charge0
Complexity1090
SMILES
COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)N4CCN(CC4)C(=O)C5=C(C=C(C=C5)F)C(F)(F)F
InChI
InChI=1S/C30H31F4N3O6S/c1-41-26-7-5-22(44(39,40)37-9-8-19-14-27(42-2)28(43-3)15-20(19)18-37)17-25(26)35-10-12-36(13-11-35)29(38)23-6-4-21(31)16-24(23)30(32,33)34/h4-7,14-17H,8-13,18H2,1-3H3
InChIKey
QVIIZVVDZZHGCB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of [4-[5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methoxyphenyl]piperazin-1-yl]-[4-fluoro-2-(trifluoromethyl)phenyl]methanone
CAS: 924811-53-0
CID: 46088742
Formula: C30H31F4N3O6S
MW: 637.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight637.6
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count7
Exact Mass637.18696954
Monoisotopic Mass637.18696954
Topological Polar Surface Area97 Ų
Heavy Atom Count44
Formal Charge0
Complexity1090
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