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N-(2H-1,3-benzodioxol-5-yl)-1,3-benzothiazol-2-amine

N-(2H-1,3-benzodioxol-5-yl)-1,3-benzothiazol-2-amine

Formula: C14H10N2O2S

SMILES: C1OC2=C(O1)C=C(NC1=NC3=CC=CC=C3S1)C=C2

IUPAC: N-(2H-1,3-benzodioxol-5-yl)-1,3-benzothiazol-2-amine

InChI: InChI=1S/C14H10N2O2S/c1-2-4-13-10(3-1)16-14(19-13)15-9-5-6-11-12(7-9)18-8-17-11/h1-7H,8H2,(H,15,16)

Composition: C (62.21%), H (3.73%), N (10.36%), O (11.84%), S (11.86%)

Molar Mass: 270.31

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 270.046298744
Formal Charge 0
FSP3 0.07
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey PLLNURJTYWMWRQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.86
Topological Polar Surface Area 43.38
Polarizability 28.8
Ring Count 4
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C14H10N2O2S $1,541.00-$2,420.00$1,541.00$1,920.00$2,420.00
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