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Su 9055

CAT: 0931-T28873-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T28873-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
653-56-5
Target
Others
Related Pathways
Others
Bioactivity
Su 9055 is an antagonist of adrenal cortex hormone.
Smiles
O=C1C(CCC=2C1=CC=CC2)C=3C=CC=NC3
Molecular Formula
C15H13NO
Molecular Weight
223.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Su 9055

structure; adrenal cortex hormone antagonist

CAS Number653-56-5
PubChem CID164715
IUPAC Name2-pyridin-3-yl-3,4-dihydro-2H-naphthalen-1-one
Molecular FormulaC15H13NO
Molecular Weight223.27
XLogP2.6
Topological Polar Surface Area30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity289
SMILES
C1CC2=CC=CC=C2C(=O)C1C3=CN=CC=C3
InChI
InChI=1S/C15H13NO/c17-15-13-6-2-1-4-11(13)7-8-14(15)12-5-3-9-16-10-12/h1-6,9-10,14H,7-8H2
InChIKey
MSUDDKYCQJQCGQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Su 9055
CAS: 653-56-5
CID: 164715
Formula: C15H13NO
MW: 223.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight223.27
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass223.099714038
Monoisotopic Mass223.099714038
Topological Polar Surface Area30 Ų
Heavy Atom Count17
Formal Charge0
Complexity289
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