2-Thia-6-aza-spiro[3.3]heptane2,2-dioxide Hydrochloride - CAS 1427388-39-3
Catalog: |
BB057399 |
Product Name: |
2-Thia-6-aza-spiro[3.3]heptane2,2-dioxide Hydrochloride |
CAS: |
1427388-39-3 |
Synonyms: |
2-Thia-6-azaspiro[3.3]heptane 2,2-dioxide hydrochloride; 2-thia-6-aza-spiro[3.3]heptane2,2-dioxide hydrochloride; 2-Thia-6-azaspiro[3.3]heptane-2,2-dioxide HCl; 2lambda6-thia-6-azaspiro[3.3]heptane 2,2-dioxide; hydrochloride; 2lambda6-thia-6-azaspiro[3.3]heptane-2,2-dione hydrochloride |
IUPAC Name: | 2λ6-thia-6-azaspiro[3.3]heptane 2,2-dioxidehydrochloride |
Description: | 2-Thia-6-aza-spiro[3.3]heptane2,2-dioxide Hydrochloride is a useful reagent for the preparation of benzopyran and imidazole derivatives. |
Molecular Weight: | 147.20 + (36.46) |
Molecular Formula: | C5H9NO2S·HCl |
Canonical SMILES: | C1C2(CN1)CS(=O)(=O)C2.Cl |
InChI: | InChI=1S/C5H9NO2S.ClH/c7-9(8)3-5(4-9)1-6-2-5/h6H,1-4H21H |
InChI Key: | CVXAFIXMQLDOKU-UHFFFAOYSA-N |
References: | Kelly, J. W., et al. PCT Int. Appl. (2020), WO 2020205683 A1. |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020025517-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
AU-2019313441-A1 | TLR7/8 antagonists and uses thereof | 20180731 |
CA-3108099-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
CN-112513024-A | TLR7/8 antagonists and uses thereof | 20180731 |
EP-3830080-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
US-2021300940-A1 | Tlr7/8 antagonists and uses thereof | 20180731 |
JP-2021533125-A | TLR7 / 8 antagonists and their use | 20180731 |
WO-2020023917-A1 | Cdk inhibitors and uses thereof | 20180727 |
AU-2019310595-A1 | CDK inhibitors and uses thereof | 20180727 |
CA-3107750-A1 | Cdk inhibitors and uses thereof | 20180727 |
Complexity: | 208 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.0120774 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.0120774 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 54.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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