Azepane-2,4-dione - CAS 29520-88-5
Catalog: |
BB020227 |
Product Name: |
Azepane-2,4-dione |
CAS: |
29520-88-5 |
Synonyms: |
azepane-2,4-dione; azepane-2,4-dione |
IUPAC Name: | azepane-2,4-dione |
Description: | Azepane-2,4-dione (CAS# 29520-88-5) is a useful research chemical. |
Molecular Weight: | 127.14 |
Molecular Formula: | C6H9NO2 |
Canonical SMILES: | C1CC(=O)CC(=O)NC1 |
InChI: | InChI=1S/C6H9NO2/c8-5-2-1-3-7-6(9)4-5/h1-4H2,(H,7,9) |
InChI Key: | IRSLHFZTRANCOL-UHFFFAOYSA-N |
LogP: | 0.18440 |
Publication Number | Title | Priority Date |
JP-2021119130-A | A drug consisting of a fused lactam derivative | 20200129 |
US-2020172543-A1 | Condensed lactam derivative | 20180723 |
WO-2020022237-A1 | Fused ring lactam derivatives | 20180723 |
US-10745401-B2 | Condensed lactam derivative | 20180723 |
US-2020255432-A1 | Condensed lactam derivative | 20180723 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 127.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 127.06332853 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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