179067-99-3
Product Name:
CPCCOET
Formula:
C13H13NO4
Synonyms:
(E)-Ethyl 1,1a,7,7a-tetrahydro-7-(hydroxyimino)cyclopropa[b]chromene-1a-carboxylate, mGlu₁ Antagonist, CPCCOEt;7-Hydroxyiminocyclopropan[b]chromen-1α-carboxylic acid ethyl ester;CPCCOEt - CAS 179067-99-3 - Calbiochem
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COMPUTED DESCRIPTORS
| Molecular Weight | 247.25 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 247.08445790 g/mol |
| Monoisotopic Mass | 247.08445790 g/mol |
| Topological Polar Surface Area | 68.1 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 395 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |