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89374-46-9 | 4H-Pyrido[3,2-e]-1,3-thiazin-4-one, 2-(2-naphthalenylamino)-
CAS No: 89374-46-9 Catalog No: AG003WG7 MDL No:
Product Description
Catalog Number:
AG003WG7
Chemical Name:
4H-Pyrido[3,2-e]-1,3-thiazin-4-one, 2-(2-naphthalenylamino)-
CAS Number:
89374-46-9
Molecular Formula:
C17H11N3OS
Molecular Weight:
305.3537
IUPAC Name:
2-(naphthalen-2-ylamino)pyrido[3,2-e][1,3]thiazin-4-one
InChI:
InChI=1S/C17H11N3OS/c21-15-14-6-3-9-18-16(14)22-17(20-15)19-13-8-7-11-4-1-2-5-12(11)10-13/h1-10H,(H,19,20,21)
InChI Key:
FGFHAUFGXCAOSS-UHFFFAOYSA-N
SMILES:
O=c1nc(Nc2ccc3c(c2)cccc3)sc2c1cccn2
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.062g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.355g/mol
Monoisotopic Mass:
305.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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