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848893-00-5 | 8-(4-METHOXYPHENYL)-2,6,7,8-TETRAHYDROIMIDAZO[2,1-C][1,2,4]TRIAZINE-3,4-D+
CAS No: 848893-00-5 Catalog No: AG01ARWW MDL No:MFCD11986648
Product Description
Catalog Number:
AG01ARWW
Chemical Name:
8-(4-METHOXYPHENYL)-2,6,7,8-TETRAHYDROIMIDAZO[2,1-C][1,2,4]TRIAZINE-3,4-D+
CAS Number:
848893-00-5
MDL Number:
MFCD11986648
IUPAC Name:
8-(4-methoxyphenyl)-6,7-dihydro-2H-imidazo[2,1-c][1,2,4]triazine-3,4-dione
InChI:
InChI=1S/C12H12N4O3/c1-19-9-4-2-8(3-5-9)15-6-7-16-11(18)10(17)13-14-12(15)16/h2-5H,6-7H2,1H3,(H,13,17)
InChI Key:
NYPJHNCSQQPCJU-UHFFFAOYSA-N
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.091g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.253g/mol
Monoisotopic Mass:
260.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| Identification of antitumour activity of novel derivatives of 8-aryl-2,6,7,8-tetrahydroimidazo[2,1-c][1,2,4]triazine-3,4-dione and 8-aryl-4-imino-2,3,7,8-tetrahydroimidazo[2,1-c][1,2,4]triazin-3(6H)-one. | Bioorganic & medicinal chemistry 20070415 |
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