3,8-Dioxa-1-azaspiro[4.5]decane-2,4-dione - CAS 39974-68-0
Catalog: |
BB024232 |
Product Name: |
3,8-Dioxa-1-azaspiro[4.5]decane-2,4-dione |
CAS: |
39974-68-0 |
Synonyms: |
3,8-dioxa-1-azaspiro[4.5]decane-2,4-dione; 3,8-dioxa-1-azaspiro[4.5]decane-2,4-dione |
IUPAC Name: | 3,8-dioxa-1-azaspiro[4.5]decane-2,4-dione |
Description: | 3,8-Dioxa-1-azaspiro[4.5]decane-2,4-dione (CAS# 39974-68-0 ) is a useful research chemical. |
Molecular Weight: | 171.15 |
Molecular Formula: | C7H9NO4 |
Canonical SMILES: | C1COCCC12C(=O)OC(=O)N2 |
InChI: | InChI=1S/C7H9NO4/c9-5-7(8-6(10)12-5)1-3-11-4-2-7/h1-4H2,(H,8,10) |
InChI Key: | DSFJJABYHBJIMB-UHFFFAOYSA-N |
LogP: | 0.13080 |
Publication Number | Title | Priority Date |
WO-2019168866-A1 | Substituted cyclohexyl compounds as nop inhibitors | 20180228 |
AU-2019229188-A1 | Substituted cyclohexyl compounds as NOP inhibitors | 20180228 |
CN-112105605-A | Substituted cyclohexyl compounds as NOP inhibitors | 20180228 |
EP-3759085-A1 | Substituted cyclohexyl compounds as nop inhibitors | 20180228 |
KR-20200140810-A | Substituted cyclohexyl compounds as NOP inhibitors | 20180228 |
Complexity: | 232 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.05315777 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 64.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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