200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 565168-52-7
565168-52-7 | 4-(ethoxymethylidene)-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-1,3-dione
CAS No: 565168-52-7 Catalog No: AG019HWU MDL No:MFCD03972115
Product Description
Catalog Number:
AG019HWU
Chemical Name:
4-(ethoxymethylidene)-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinoline-1,3-dione
CAS Number:
565168-52-7
Molecular Formula:
C21H21NO3
Molecular Weight:
335.3963
MDL Number:
MFCD03972115
IUPAC Name:
4-(ethoxymethylidene)-2-(4-propan-2-ylphenyl)isoquinoline-1,3-dione
InChI:
InChI=1S/C21H21NO3/c1-4-25-13-19-17-7-5-6-8-18(17)20(23)22(21(19)24)16-11-9-15(10-12-16)14(2)3/h5-14H,4H2,1-3H3
InChI Key:
AGWYUPVCBZBQMG-UHFFFAOYSA-N
SMILES:
CCOC=C1C(=O)N(c2ccc(cc2)C(C)C)C(=O)c2c1cccc2
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.152g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.403g/mol
Monoisotopic Mass:
335.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.