Text Search
Structure Search

2-{3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamido}benzoic acid

2-{3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamido}benzoic acid

Formula: C19H17N3O5

SMILES: COC1=CC=CC=C1C1=NOC(CCC(=O)NC2=CC=CC=C2C(O)=O)=N1

IUPAC: 2-{3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamido}benzoic acid

InChI: InChI=1S/C19H17N3O5/c1-26-15-9-5-3-7-13(15)18-21-17(27-22-18)11-10-16(23)20-14-8-4-2-6-12(14)19(24)25/h2-9H,10-11H2,1H3,(H,20,23)(H,24,25)

Composition: C (62.12%), H (4.66%), N (11.44%), O (21.78%)

Molar Mass: 367.361

Atom Count: 44

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 367.116820659
Formal Charge 0
FSP3 0.16
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey FPTVKOSZGXPAHB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.42
Topological Polar Surface Area 114.55
Polarizability 36.92
Ring Count 3
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H17N3O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote