338960-00-2
Product Name:
ETHYL 4-(3-BROMOPHENYL)-2-METHYL-6-OXO-1,4,5,6-TETRAHYDRO-3-PYRIDINECARBOXYLATE
Formula:
C15H16BrNO3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 338.20 g/mol |
---|---|
XLogP3 | 2.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 337.03136 g/mol |
Monoisotopic Mass | 337.03136 g/mol |
Topological Polar Surface Area | 55.4 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 433 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |