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5-chloro-2-methoxy-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide

5-chloro-2-methoxy-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide

Formula: C11H7ClF3N3O2S

SMILES: COC1=CC=C(Cl)C=C1C(=O)NC1=NN=C(S1)C(F)(F)F

IUPAC: 5-chloro-2-methoxy-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide

InChI: InChI=1S/C11H7ClF3N3O2S/c1-20-7-3-2-5(12)4-6(7)8(19)16-10-18-17-9(21-10)11(13,14)15/h2-4H,1H3,(H,16,18,19)

Composition: C (39.12%), H (2.09%), Cl (10.50%), F (16.88%), N (12.44%), O (9.48%), S (9.49%)

Molar Mass: 337.7

Atom Count: 28

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 336.9899598
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey GQOWLAIZUKOJJK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.11
Topological Polar Surface Area 64.11
Polarizability 25.85
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H7ClF3N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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