1-(4-aminophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepin-4-one


Chemical Name: 1-(4-aminophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepin-4-one
CAS Number: 178616-26-7
Product Number: AG00266W(AGN-PC-0LA2O1)
Synonyms:
MDL No:
Molecular Formula: C17H17N3O3
Molecular Weight: 311.3352

Identification/Properties


Computed Properties
Molecular Weight:
311.341g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
311.127g/mol
Monoisotopic Mass:
311.127g/mol
Topological Polar Surface Area:
85.9A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
460
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

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
N/A
Hazard Statements:
-
Precautionary Statements:
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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