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78439-67-5 | 9-METHOXY-4-((4-PYRIDINYLMETHYLENE)AMINO)-7H-FURO[3,2-G]CHROMEN-7-ONE
CAS No: 78439-67-5 Catalog No: AG0053IP MDL No:
Product Description
Catalog Number:
AG0053IP
Chemical Name:
9-METHOXY-4-((4-PYRIDINYLMETHYLENE)AMINO)-7H-FURO[3,2-G]CHROMEN-7-ONE
CAS Number:
78439-67-5
Molecular Formula:
C18H12N2O4
Molecular Weight:
320.2989
IUPAC Name:
9-methoxy-4-(pyridin-4-ylmethylideneamino)furo[3,2-g]chromen-7-one
InChI:
InChI=1S/C18H12N2O4/c1-22-18-16-13(6-9-23-16)15(12-2-3-14(21)24-17(12)18)20-10-11-4-7-19-8-5-11/h2-10H,1H3
InChI Key:
UDOVBHTUBOROTA-UHFFFAOYSA-N
SMILES:
COc1c2occc2c(c2c1oc(=O)cc2)N=Cc1ccncc1
NSC Number:
350259
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.08g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.304g/mol
Monoisotopic Mass:
320.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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