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AZD-3783

CAT: 0931-T71357-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T71357-01Size:25 mg
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CAS Number
1162658-64-1
Target
Others
Related Pathways
Others
Bioactivity
AZD-3783 is a selective 5-hydroxytryptamine 1B receptor antagonist with probable antidepressant and anxiolytic activity.
Smiles
C(NC1=CC=C(C=C1)N2CCOCC2)(=O)[C@@H]3OC4=C(C=C(OC)C=C4CC3)N5CCN(C)CC5
Molecular Formula
C26H34N4O4
Molecular Weight
466.57
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(2R)-6-methoxy-8-(4-methylpiperazin-1-yl)-N-(4-morpholin-4-ylphenyl)chromane-2-carboxamide

structure in first source

CAS Number1162658-64-1
PubChem CID25067561
IUPAC Name(2R)-6-methoxy-8-(4-methylpiperazin-1-yl)-N-(4-morpholin-4-ylphenyl)-3,4-dihydro-2H-chromene-2-carboxamide
Molecular FormulaC26H34N4O4
Molecular Weight466.6
XLogP2.9
Topological Polar Surface Area66.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity659
SMILES
CN1CCN(CC1)C2=CC(=CC3=C2O[C@H](CC3)C(=O)NC4=CC=C(C=C4)N5CCOCC5)OC
InChI
InChI=1S/C26H34N4O4/c1-28-9-11-30(12-10-28)23-18-22(32-2)17-19-3-8-24(34-25(19)23)26(31)27-20-4-6-21(7-5-20)29-13-15-33-16-14-29/h4-7,17-18,24H,3,8-16H2,1-2H3,(H,27,31)/t24-/m1/s1
InChIKey
SKOWCFJEXPLGNE-XMMPIXPASA-N
Chemical Structure
2D Structure
2D structure of (2R)-6-methoxy-8-(4-methylpiperazin-1-yl)-N-(4-morpholin-4-ylphenyl)chromane-2-carboxamide
CAS: 1162658-64-1
CID: 25067561
Formula: C26H34N4O4
MW: 466.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight466.6
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass466.25800558
Monoisotopic Mass466.25800558
Topological Polar Surface Area66.5 Ų
Heavy Atom Count34
Formal Charge0
Complexity659
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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