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2-{2-[(3-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methyl]diazen-1-yl}-1,3-benzothiazole

2-{2-[(3-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methyl]diazen-1-yl}-1,3-benzothiazole

Formula: C25H23N3O2S

SMILES: C=CCC1=CC=CC=C1OCCOC1=CC=CC(CN=NC2=NC3=CC=CC=C3S2)=C1

IUPAC: 2-{2-[(3-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methyl]diazen-1-yl}-1,3-benzothiazole

InChI: InChI=1S/C25H23N3O2S/c1-2-8-20-10-3-5-13-23(20)30-16-15-29-21-11-7-9-19(17-21)18-26-28-25-27-22-12-4-6-14-24(22)31-25/h2-7,9-14,17H,1,8,15-16,18H2

Composition: C (69.91%), H (5.40%), N (9.78%), O (7.45%), S (7.46%)

Molar Mass: 429.54

Atom Count: 54

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 429.151098167
Formal Charge 0
FSP3 0.16
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey CCLYDWPOSVXWEC-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 125.04
Topological Polar Surface Area 56.07
Polarizability 48.68
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 C25H23N3O2S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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