105219-56-5
Product Name:
Apafant
Formula:
C22H22ClN5O2S
Synonyms:
3-[4-(2-Chlorophenyl)-9-methyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-2-yl]-1-(4-morpholinyl)-1-propanone;Apafant;WEB 2086BS
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COMPUTED DESCRIPTORS
| Molecular Weight | 456.0 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 455.1182738 g/mol |
| Monoisotopic Mass | 455.1182738 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 691 |
| 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 |
PRODUCT INTRODUCTION
description
LSM-2613 is an organonitrogen heterocyclic compound and an organosulfur heterocyclic compound.