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YLT205

CAT: 0931-T24660-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T24660-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1316196-63-0
Target
Apoptosis, Others
Related Pathways
Others, Apoptosis
Bioactivity
YLT205 is an inducer of apoptosis in human colorectal cells that acts by inhibiting tumor growth.
Smiles
S(CC(NC1=CC=C(Br)C=N1)=O)C2=NC=3C(S2)=CC(NC(CCl)=O)=CC3
Molecular Formula
C16H12BrClN4O2S2
Molecular Weight
471.78
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(5-bromo-2-pyridinyl)-2-[[6-[(2-chloroacetyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide
CAS Number1316196-63-0
PubChem CID54764750
IUPAC NameN-(5-bromo-2-pyridinyl)-2-[[6-[(2-chloroacetyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide
Molecular FormulaC16H12BrClN4O2S2
Molecular Weight471.8
XLogP3.9
Topological Polar Surface Area138
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count26
Formal Charge0
Complexity519
SMILES
C1=CC2=C(C=C1NC(=O)CCl)SC(=N2)SCC(=O)NC3=NC=C(C=C3)Br
InChI
InChI=1S/C16H12BrClN4O2S2/c17-9-1-4-13(19-7-9)22-15(24)8-25-16-21-11-3-2-10(5-12(11)26-16)20-14(23)6-18/h1-5,7H,6,8H2,(H,20,23)(H,19,22,24)
InChIKey
QKMMRERCAFXACY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(5-bromo-2-pyridinyl)-2-[[6-[(2-chloroacetyl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetamide
CAS: 1316196-63-0
CID: 54764750
Formula: C16H12BrClN4O2S2
MW: 471.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight471.8
XLogP33.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass469.92736
Monoisotopic Mass469.92736
Topological Polar Surface Area138 Ų
Heavy Atom Count26
Formal Charge0
Complexity519
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
GTR19199771-01YLT205

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