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119504-50-6 | 2H-Pyrido[4,3-e]-1,3-thiazine (9CI)
CAS No: 119504-50-6 Catalog No: AG000IW1 MDL No:MFCD28044991
Product Description
Catalog Number:
AG000IW1
Chemical Name:
2H-Pyrido[4,3-e]-1,3-thiazine (9CI)
CAS Number:
119504-50-6
Molecular Formula:
C7H6N2S
Molecular Weight:
150.2009
MDL Number:
MFCD28044991
IUPAC Name:
2H-pyrido[4,3-e][1,3]thiazine
InChI:
InChI=1S/C7H6N2S/c1-2-8-4-7-6(1)3-9-5-10-7/h1-4H,5H2
InChI Key:
ZGOLORIZFYHUSW-UHFFFAOYSA-N
SMILES:
C1N=Cc2c(S1)cncc2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.199g/mol
Monoisotopic Mass:
150.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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