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Org-10490

CAT: 0931-T12318-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T12318-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
83507-02-2
Target
Others, Dopamine Receptor
Related Pathways
Others, GPCR/G Protein, Neuroscience
Bioactivity
Org-10490 is an dopamine D1 receptor and dopamine D2 receptor antagonist, and treatment for psychiatric disease.
Smiles
CN1CCC=2C(OC=3C(CC1)=CC=CC3)=CC=CC2
Molecular Formula
C17H19NO
Molecular Weight
253.34
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

11-Methyl-2-oxa-11-azatricyclo[12.4.0.03,8]octadeca-1(18),3,5,7,14,16-hexaene
CAS Number83507-02-2
PubChem CID3086163
IUPAC Name11-methyl-2-oxa-11-azatricyclo[12.4.0.03,8]octadeca-1(18),3,5,7,14,16-hexaene
Molecular FormulaC17H19NO
Molecular Weight253.34
XLogP3.8
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity254
SMILES
CN1CCC2=CC=CC=C2OC3=CC=CC=C3CC1
InChI
InChI=1S/C17H19NO/c1-18-12-10-14-6-2-4-8-16(14)19-17-9-5-3-7-15(17)11-13-18/h2-9H,10-13H2,1H3
InChIKey
NREYMNFZCFNECP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 11-Methyl-2-oxa-11-azatricyclo[12.4.0.03,8]octadeca-1(18),3,5,7,14,16-hexaene
CAS: 83507-02-2
CID: 3086163
Formula: C17H19NO
MW: 253.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight253.34
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass253.146664230
Monoisotopic Mass253.146664230
Topological Polar Surface Area12.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity254
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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