338406-22-7
Product Name:
ETHYL 2-[4-(2,6-DIMETHYLPHENYL)PIPERAZINO]-5-(4-METHYLPHENYL)-1H-PYRROLE-3-CARBOXYLATE
Formula:
C26H31N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 417.5 g/mol |
---|---|
XLogP3 | 5.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 417.24162724 g/mol |
Monoisotopic Mass | 417.24162724 g/mol |
Topological Polar Surface Area | 48.6 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 573 |
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 |