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TH 257

CAT: 1410-M20839-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M20839-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TH 257 is a Potent and selective allosteric LIMK 1/2 inhibitor (LIMK1 and LIMK2 IC50 of 84 nM and 39 nM) .
CAS Number
2244678-29-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
422.5
Molecular Formula
C24H26N2O3S
Notes
Research use only, not for human use.
Receptor
LIMK

Chemical Information

N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CAS Number2244678-29-1
PubChem CID137796294
IUPAC NameN-benzyl-N-butyl-4-(phenylsulfamoyl)benzamide
Molecular FormulaC24H26N2O3S
Molecular Weight422.5
XLogP4.7
Topological Polar Surface Area74.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count30
Formal Charge0
Complexity611
SMILES
CCCCN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3
InChI
InChI=1S/C24H26N2O3S/c1-2-3-18-26(19-20-10-6-4-7-11-20)24(27)21-14-16-23(17-15-21)30(28,29)25-22-12-8-5-9-13-22/h4-17,25H,2-3,18-19H2,1H3
InChIKey
VNCIWNGCMAKKEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CAS: 2244678-29-1
CID: 137796294
Formula: C24H26N2O3S
MW: 422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.5
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass422.16641387
Monoisotopic Mass422.16641387
Topological Polar Surface Area74.9 Ų
Heavy Atom Count30
Formal Charge0
Complexity611
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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