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Ro 363

CAT: 0013-GTR19203176-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203176-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ro 363
CAS Number
74513-77-2
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
O (C) C1=C (OC) C=C (CCNCC (COC2=CC (O) =C (O) C=C2) O) C=C1
Molecular Formula
C19H25NO6
Molecular Weight
363.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ro 363
CAS Number74513-77-2
PubChem CID156297
IUPAC Name4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]benzene-1,2-diol
Molecular FormulaC19H25NO6
Molecular Weight363.4
XLogP1.9
Topological Polar Surface Area100
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Heavy Atom Count26
Formal Charge0
Complexity385
SMILES
COC1=C(C=C(C=C1)CCNCC(COC2=CC(=C(C=C2)O)O)O)OC
InChI
InChI=1S/C19H25NO6/c1-24-18-6-3-13(9-19(18)25-2)7-8-20-11-14(21)12-26-15-4-5-16(22)17(23)10-15/h3-6,9-10,14,20-23H,7-8,11-12H2,1-2H3
InChIKey
RFNBEBPVKCJZPV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ro 363
CAS: 74513-77-2
CID: 156297
Formula: C19H25NO6
MW: 363.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.4
XLogP31.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count10
Exact Mass363.16818752
Monoisotopic Mass363.16818752
Topological Polar Surface Area100 Ų
Heavy Atom Count26
Formal Charge0
Complexity385
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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