321522-13-8
Product Name:
ETHYL 5-[[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL](METHYL)AMINO]-3-(1,3-DIOXO-1,3-DIHYDRO-2H-INDEN-2-YLIDEN)-4,6-DIOXOOCTAHYDROPYRROLO[3,4-C]PYRROLE-1-CARBOXYLATE
Formula:
C25H18ClF3N4O6
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COMPUTED DESCRIPTORS
Molecular Weight | 562.9 g/mol |
---|---|
XLogP3 | 3.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 12 |
Rotatable Bond Count | 6 |
Exact Mass | 562.0866965 g/mol |
Monoisotopic Mass | 562.0866965 g/mol |
Topological Polar Surface Area | 130 Ų |
Heavy Atom Count | 39 |
Formal Charge | 0 |
Complexity | 1160 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 3 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |