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TP-472N

CAT: 0931-T39486Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T39486Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2080306-24-5
Target
Epigenetic Reader Domain, Others
Related Pathways
Others, Chromatin/Epigenetic
Bioactivity
TP-472N serves as a negative control probe for TP-472, which is a specific and effective BRD7/9 probe.
Smiles
CC(=O)c1cc(-c2ccccc2OCC2CC2)c2ncccn12
Molecular Formula
C19H18N2O2
Molecular Weight
306.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(8-(2-(Cyclopropylmethoxy)phenyl)pyrrolo[1,2-a]pyrimidin-6-yl)ethanone
CAS Number2080306-24-5
PubChem CID124201853
IUPAC Name1-[8-[2-(cyclopropylmethoxy)phenyl]pyrrolo[1,2-a]pyrimidin-6-yl]ethanone
Molecular FormulaC19H18N2O2
Molecular Weight306.4
XLogP4.1
Topological Polar Surface Area43.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity437
SMILES
CC(=O)C1=CC(=C2N1C=CC=N2)C3=CC=CC=C3OCC4CC4
InChI
InChI=1S/C19H18N2O2/c1-13(22)17-11-16(19-20-9-4-10-21(17)19)15-5-2-3-6-18(15)23-12-14-7-8-14/h2-6,9-11,14H,7-8,12H2,1H3
InChIKey
IDQWBZAMTQTECP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(8-(2-(Cyclopropylmethoxy)phenyl)pyrrolo[1,2-a]pyrimidin-6-yl)ethanone
CAS: 2080306-24-5
CID: 124201853
Formula: C19H18N2O2
MW: 306.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.4
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass306.136827821
Monoisotopic Mass306.136827821
Topological Polar Surface Area43.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity437
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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