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23654-69-5

23654-69-5 | 4H-1,3-Benzothiazine, 6,7-dimethoxy-2-phenyl-

CAS No: 23654-69-5 Catalog No: AG002O1W MDL No:

Product Description

Catalog Number:
AG002O1W
Chemical Name:
4H-1,3-Benzothiazine, 6,7-dimethoxy-2-phenyl-
CAS Number:
23654-69-5
Molecular Formula:
C16H15NO2S
Molecular Weight:
285.3608
IUPAC Name:
6,7-dimethoxy-2-phenyl-4H-1,3-benzothiazine
InChI:
InChI=1S/C16H15NO2S/c1-18-13-8-12-10-17-16(11-6-4-3-5-7-11)20-15(12)9-14(13)19-2/h3-9H,10H2,1-2H3
InChI Key:
FMVSILSTBPNIKJ-UHFFFAOYSA-N
SMILES:
COc1cc2SC(=NCc2cc1OC)c1ccccc1

Properties

Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.082g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.361g/mol
Monoisotopic Mass:
285.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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