101954-20-5
Product Name:
EMEDASTINE IMPURITY E
Formula:
C16H24N4O
Synonyms:
1-(2-Ethoxyethyl)-2-(hexahydro-1H-1,4-diazepin-1-yl)-1H-benzimidazole
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COMPUTED DESCRIPTORS
| Molecular Weight | 288.39 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 288.19501140 g/mol |
| Monoisotopic Mass | 288.19501140 g/mol |
| Topological Polar Surface Area | 42.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 315 |
| 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 |