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L755507

CAT: 0931-T6872-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T6872-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
159182-43-1
Target
CRISPR/Cas9, Adrenergic Receptor
Related Pathways
Neuroscience, DNA Damage/DNA Repair, GPCR/G Protein
Purity
0.9988
Bioactivity
L755507 is an effective, selective agonist of β3-AR (IC50=35 nM) .
Smiles
CCCCCCNC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(CCNC[C@H](O)COc2ccc(O)cc2)cc1
Molecular Formula
C30H40N4O6S
Molecular Weight
584.73
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-hexyl-3-[4-[[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]sulfamoyl]phenyl]urea
CAS Number159182-43-1
PubChem CID9829836
IUPAC Name1-hexyl-3-[4-[[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]sulfamoyl]phenyl]urea
Molecular FormulaC30H40N4O6S
Molecular Weight584.7
XLogP4.3
Topological Polar Surface Area157
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count17
Heavy Atom Count41
Formal Charge0
Complexity817
SMILES
CCCCCCNC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)CCNC[C@@H](COC3=CC=C(C=C3)O)O
InChI
InChI=1S/C30H40N4O6S/c1-2-3-4-5-19-32-30(37)33-24-10-16-29(17-11-24)41(38,39)34-25-8-6-23(7-9-25)18-20-31-21-27(36)22-40-28-14-12-26(35)13-15-28/h6-17,27,31,34-36H,2-5,18-22H2,1H3,(H2,32,33,37)/t27-/m0/s1
InChIKey
NYYJKMXNVNFOFQ-MHZLTWQESA-N
Chemical Structure
2D Structure
2D structure of 1-hexyl-3-[4-[[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]sulfamoyl]phenyl]urea
CAS: 159182-43-1
CID: 9829836
Formula: C30H40N4O6S
MW: 584.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight584.7
XLogP34.3
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count17
Exact Mass584.26685618
Monoisotopic Mass584.26685618
Topological Polar Surface Area157 Ų
Heavy Atom Count41
Formal Charge0
Complexity817
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
A16593-1L755507 1mg
TRC-L009900-100MGL755507
A16593-5L755507 5mg
A16593-100L755507 100mg
A16593-25L755507 25mg
A16593-50L755507 50mg
A16593-10L755507 10mg
453498-01L755507 discontinued. See 255640
A16593-10mM-DL755507 10mM * 1mL in DMSO

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