7-[4-[2-(2,3-dichloroanilino)ethylamino]butoxy]-3,4-dihydro-1H-quinolin-2-one


Chemical Name: 7-[4-[2-(2,3-dichloroanilino)ethylamino]butoxy]-3,4-dihydro-1H-quinolin-2-one
CAS Number: 1216394-63-6
Product Number: AG0015G9(AGN-PC-0BEPQA)
Synonyms:
MDL No:
Molecular Formula: C21H25Cl2N3O2
Molecular Weight: 422.3481

Identification/Properties


Computed Properties
Molecular Weight:
422.35g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
10
Exact Mass:
421.132g/mol
Monoisotopic Mass:
421.132g/mol
Topological Polar Surface Area:
62.4A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
483
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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