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Home > Pyridines > 1090031-41-6
1090031-41-6 | N-(6-methylpyridin-2-yl)-5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxamide
CAS No: 1090031-41-6 Catalog No: AG01ALXJ MDL No:MFCD11739781
Product Description
Catalog Number:
AG01ALXJ
Chemical Name:
N-(6-methylpyridin-2-yl)-5,9-dithia-1,7-diazatricyclo[6.3.0.0,2,6]undeca-2(6),3,7,10-tetraene-4-carboxamide
CAS Number:
1090031-41-6
Molecular Formula:
C14H10N4OS2
Molecular Weight:
314.3854
MDL Number:
MFCD11739781
IUPAC Name:
N-(6-methylpyridin-2-yl)-5,9-dithia-1,7-diazatricyclo[6.3.0.02,6]undeca-2(6),3,7,10-tetraene-4-carboxamide
InChI:
InChI=1S/C14H10N4OS2/c1-8-3-2-4-11(15-8)16-12(19)10-7-9-13(21-10)17-14-18(9)5-6-20-14/h2-7H,1H3,(H,15,16,19)
InChI Key:
OJSVKQNGMHPIFM-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)NC(=O)c1sc2c(c1)n1c(n2)scc1
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.03g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.381g/mol
Monoisotopic Mass:
314.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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