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Home > Imidazoles > 70966-23-3
70966-23-3 | 7H-Imidazo[1,2-b][1,2,4]triazepin-8(9H)-one, 6,9-dimethyl-2,3-diphenyl-
CAS No: 70966-23-3 Catalog No: AG005FK3 MDL No:
Product Description
Catalog Number:
AG005FK3
Chemical Name:
7H-Imidazo[1,2-b][1,2,4]triazepin-8(9H)-one, 6,9-dimethyl-2,3-diphenyl-
CAS Number:
70966-23-3
Molecular Formula:
C20H18N4O
Molecular Weight:
330.3831
IUPAC Name:
6,9-dimethyl-2,3-diphenyl-7H-imidazo[1,2-b][1,2,4]triazepin-8-one
InChI:
InChI=1S/C20H18N4O/c1-14-13-17(25)23(2)20-21-18(15-9-5-3-6-10-15)19(24(20)22-14)16-11-7-4-8-12-16/h3-12H,13H2,1-2H3
InChI Key:
HTIKBFBIVGQZGX-UHFFFAOYSA-N
SMILES:
CC1=Nn2c(N(C(=O)C1)C)nc(c2c1ccccc1)c1ccccc1
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.148g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.391g/mol
Monoisotopic Mass:
330.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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