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TH251

CAT: 0931-T70364-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T70364-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1622059-04-4
Target
Others
Related Pathways
Others
Bioactivity
TH251 is a highly selective antagonist of LIMK1 and LIMK2 (LIMK1/2) .
Smiles
C(N(CC1=CC=CC=C1)CC)(=O)C2=CC=C(S(NC3=CC=CC=C3)(=O)=O)C=C2
Molecular Formula
C22H22N2O3S
Molecular Weight
394.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-Benzyl-N-ethyl-4-(N-phenylsulfamoyl)benzamide
CAS Number1622059-04-4
PubChem CID37311853
IUPAC NameN-benzyl-N-ethyl-4-(phenylsulfamoyl)benzamide
Molecular FormulaC22H22N2O3S
Molecular Weight394.5
XLogP3.8
Topological Polar Surface Area74.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity581
SMILES
CCN(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3
InChI
InChI=1S/C22H22N2O3S/c1-2-24(17-18-9-5-3-6-10-18)22(25)19-13-15-21(16-14-19)28(26,27)23-20-11-7-4-8-12-20/h3-16,23H,2,17H2,1H3
InChIKey
HSFGCMJKYHQRQQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Benzyl-N-ethyl-4-(N-phenylsulfamoyl)benzamide
CAS: 1622059-04-4
CID: 37311853
Formula: C22H22N2O3S
MW: 394.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.5
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass394.13511374
Monoisotopic Mass394.13511374
Topological Polar Surface Area74.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity581
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

Alternative Products

CatalogName
GTR19209617-01TH251

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