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1222-84-0 | Benzenamine, N-[2-(3-methyl-2(3H)-benzothiazolylidene)ethylidene]-
CAS No: 1222-84-0 Catalog No: AG0016XF MDL No:
Product Description
Catalog Number:
AG0016XF
Chemical Name:
Benzenamine, N-[2-(3-methyl-2(3H)-benzothiazolylidene)ethylidene]-
CAS Number:
1222-84-0
Molecular Formula:
C16H14N2S
Molecular Weight:
266.3608
IUPAC Name:
2-(3-methyl-1,3-benzothiazol-2-ylidene)-N-phenylethanimine
InChI:
InChI=1S/C16H14N2S/c1-18-14-9-5-6-10-15(14)19-16(18)11-12-17-13-7-3-2-4-8-13/h2-12H,1H3
InChI Key:
WPAWCEDYOJAKSM-UHFFFAOYSA-N
SMILES:
Cn1c(=CC=Nc2ccccc2)sc2c1cccc2
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.362g/mol
Monoisotopic Mass:
266.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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