COMPUTED DESCRIPTORS
Molecular Weight | 321.37 g/mol |
---|---|
XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 11 |
Exact Mass | 321.16885622 g/mol |
Monoisotopic Mass | 321.16885622 g/mol |
Topological Polar Surface Area | 117 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 400 |
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 |
PRODUCT INTRODUCTION
description
4-[6-(diaminomethylideneamino)-1-oxohexoxy]benzoic acid ethyl ester is a benzoate ester.