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IMT1

CAT: 0931-T8841-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T8841-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2304621-31-4
Target
OXPHOS, DNA/RNA Synthesis, Mitochondrial Metabolism
Related Pathways
Cell Cycle/Checkpoint, DNA Damage/DNA Repair, Apoptosis, Metabolism
Purity
0.9814
Bioactivity
IMT1 (Propanamide, N, N-dimethyl-2-[[4- (2-methylphenyl) -2-oxo-2H-1-benzopyran-7-yl]oxy]-) has anticancer activity.
Smiles
CC(Oc1ccc2c(cc(=O)oc2c1)-c1ccccc1C)C(=O)N(C)C
Molecular Formula
C21H21NO4
Molecular Weight
351.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N,N-dimethyl-2-((2-oxo-4-(o-tolyl)-2H-chromen-7-yl)oxy)propanamide
CAS Number2304621-31-4
PubChem CID138490559
IUPAC NameN,N-dimethyl-2-[4-(2-methylphenyl)-2-oxochromen-7-yl]oxypropanamide
Molecular FormulaC21H21NO4
Molecular Weight351.4
XLogP3.4
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity570
SMILES
CC1=CC=CC=C1C2=CC(=O)OC3=C2C=CC(=C3)OC(C)C(=O)N(C)C
InChI
InChI=1S/C21H21NO4/c1-13-7-5-6-8-16(13)18-12-20(23)26-19-11-15(9-10-17(18)19)25-14(2)21(24)22(3)4/h5-12,14H,1-4H3
InChIKey
DBIPGWVTQBAHGP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N,N-dimethyl-2-((2-oxo-4-(o-tolyl)-2H-chromen-7-yl)oxy)propanamide
CAS: 2304621-31-4
CID: 138490559
Formula: C21H21NO4
MW: 351.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight351.4
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass351.14705815
Monoisotopic Mass351.14705815
Topological Polar Surface Area55.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity570
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T8842-01IMT1B