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89374-51-6 | 4H-Pyrido[3,2-e]-1,3-thiazin-4-one, 2-(methylphenylamino)-
CAS No: 89374-51-6 Catalog No: AG003WG5 MDL No:
Product Description
Catalog Number:
AG003WG5
Chemical Name:
4H-Pyrido[3,2-e]-1,3-thiazin-4-one, 2-(methylphenylamino)-
CAS Number:
89374-51-6
Molecular Formula:
C14H11N3OS
Molecular Weight:
269.3216
IUPAC Name:
2-(N-methylanilino)pyrido[3,2-e][1,3]thiazin-4-one
InChI:
InChI=1S/C14H11N3OS/c1-17(10-6-3-2-4-7-10)14-16-12(18)11-8-5-9-15-13(11)19-14/h2-9H,1H3
InChI Key:
ZVNJXNYTWXDGGJ-UHFFFAOYSA-N
SMILES:
CN(c1nc(=O)c2c(s1)nccc2)c1ccccc1
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.062g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.322g/mol
Monoisotopic Mass:
269.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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