200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 87540-49-6
87540-49-6 | 1,2,4-Triazolo[3,4-a]phthalazine,3-(3,4-dimethoxyphenyl)-6-ethoxy-
CAS No: 87540-49-6 Catalog No: AG004EZV MDL No:
Product Description
Catalog Number:
AG004EZV
Chemical Name:
1,2,4-Triazolo[3,4-a]phthalazine,3-(3,4-dimethoxyphenyl)-6-ethoxy-
CAS Number:
87540-49-6
Molecular Formula:
C19H18N4O3
Molecular Weight:
350.3712
IUPAC Name:
3-(3,4-dimethoxyphenyl)-6-ethoxy-[1,2,4]triazolo[3,4-a]phthalazine
InChI:
InChI=1S/C19H18N4O3/c1-4-26-19-14-8-6-5-7-13(14)18-21-20-17(23(18)22-19)12-9-10-15(24-2)16(11-12)25-3/h5-11H,4H2,1-3H3
InChI Key:
OHNXXAVUGGTUCJ-UHFFFAOYSA-N
SMILES:
CCOc1nn2c(nnc2c2c1cccc2)c1ccc(c(c1)OC)OC
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.138g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.378g/mol
Monoisotopic Mass:
350.138g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.