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Autophagy-IN-A9

CAT: 0931-T9181-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-T9181-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1262888-20-9
Target
Autophagy, Apoptosis, DUB, Others
Related Pathways
Others, Apoptosis, Cell Cycle/Checkpoint, DNA Damage/DNA Repair, Autophagy, Ubiquitination
Purity
>99.99%
Bioactivity
Autophagy-IN-A9 is a bioactive chemical.
Smiles
N(CC1=CC=C(Cl)C=C1)C=2C3=C(N=CN2)C=CC(F)=C3
Molecular Formula
C15H11ClFN3
Molecular Weight
287.72
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Autophagy-IN-A9
CAS Number1262888-20-9
PubChem CID51037840
IUPAC NameN-[(4-chlorophenyl)methyl]-6-fluoroquinazolin-4-amine
Molecular FormulaC15H11ClFN3
Molecular Weight287.72
XLogP4.1
Topological Polar Surface Area37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity309
SMILES
C1=CC(=CC=C1CNC2=NC=NC3=C2C=C(C=C3)F)Cl
InChI
InChI=1S/C15H11ClFN3/c16-11-3-1-10(2-4-11)8-18-15-13-7-12(17)5-6-14(13)19-9-20-15/h1-7,9H,8H2,(H,18,19,20)
InChIKey
UKKFWKDNHGAJTR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Autophagy-IN-A9
CAS: 1262888-20-9
CID: 51037840
Formula: C15H11ClFN3
MW: 287.72
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight287.72
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass287.0625532
Monoisotopic Mass287.0625532
Topological Polar Surface Area37.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity309
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