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[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl 1H-indole-3-carboxylate

[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl 1H-indole-3-carboxylate

Formula: C19H13N3O5

SMILES: O=C(OCC1=NC(=NO1)C1=CC=C2OCOC2=C1)C1=CNC2=CC=CC=C12

IUPAC: [3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl 1H-indole-3-carboxylate

InChI: InChI=1S/C19H13N3O5/c23-19(13-8-20-14-4-2-1-3-12(13)14)24-9-17-21-18(22-27-17)11-5-6-15-16(7-11)26-10-25-15/h1-8,20H,9-10H2

Composition: C (62.81%), H (3.61%), N (11.57%), O (22.02%)

Molar Mass: 363.329

Atom Count: 40

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 363.085520531
Formal Charge 0
FSP3 0.11
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey XNLREFSOTYOZKK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.9
Topological Polar Surface Area 99.47
Polarizability 37.41
Ring Count 5
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H13N3O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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