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2-[2-({4-[3-(2-chlorophenoxy)propoxy]-3-methoxyphenyl}methyl)diazen-1-yl]-1,3-benzothiazole

2-[2-({4-[3-(2-chlorophenoxy)propoxy]-3-methoxyphenyl}methyl)diazen-1-yl]-1,3-benzothiazole

Formula: C24H22ClN3O3S

SMILES: COC1=CC(CN=NC2=NC3=CC=CC=C3S2)=CC=C1OCCCOC1=CC=CC=C1Cl

IUPAC: 2-[2-({4-[3-(2-chlorophenoxy)propoxy]-3-methoxyphenyl}methyl)diazen-1-yl]-1,3-benzothiazole

InChI: InChI=1S/C24H22ClN3O3S/c1-29-22-15-17(16-26-28-24-27-19-8-3-5-10-23(19)32-24)11-12-21(22)31-14-6-13-30-20-9-4-2-7-18(20)25/h2-5,7-12,15H,6,13-14,16H2,1H3

Composition: C (61.60%), H (4.74%), Cl (7.58%), N (8.98%), O (10.26%), S (6.85%)

Molar Mass: 467.97

Atom Count: 54

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 467.1070405
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey MSLJDHUHIWZOKX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 126.89
Topological Polar Surface Area 65.3
Polarizability 49.63
Ring Count 4
Rotatable Bond Count 10

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H22ClN3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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