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2-(3-methylphenoxy)-N-[5-(thiophen-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

2-(3-methylphenoxy)-N-[5-(thiophen-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

Formula: C15H13N3O2S2

SMILES: CC1=CC(OCC(=O)NC2=NN=C(S2)C2=CC=CS2)=CC=C1

IUPAC: 2-(3-methylphenoxy)-N-[5-(thiophen-2-yl)-1,3,4-thiadiazol-2-yl]acetamide

InChI: InChI=1S/C15H13N3O2S2/c1-10-4-2-5-11(8-10)20-9-13(19)16-15-18-17-14(22-15)12-6-3-7-21-12/h2-8H,9H2,1H3,(H,16,18,19)

Composition: C (54.36%), H (3.95%), N (12.68%), O (9.66%), S (19.35%)

Molar Mass: 331.41

Atom Count: 35

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 331.044919019
Formal Charge 0
FSP3 0.13
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FRXZNWRABMRRRV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.72
Topological Polar Surface Area 64.11
Polarizability 33.16
Ring Count 3
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H13N3O2S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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