338420-26-1
Product Name:
DIMETHYL 5-(4-CHLOROPHENYL)-4,6-DIOXOTETRAHYDRO-2H-PYRROLO[3,4-D]ISOXAZOLE-3,3(3AH)-DICARBOXYLATE
Formula:
C15H13ClN2O7
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COMPUTED DESCRIPTORS
Molecular Weight | 368.72 g/mol |
---|---|
XLogP3 | 0.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 5 |
Exact Mass | 368.0411285 g/mol |
Monoisotopic Mass | 368.0411285 g/mol |
Topological Polar Surface Area | 111 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 601 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |