6-Chloro-N-methylpyridine-3-sulfonamide - CAS 52480-30-5
Catalog: |
BB027841 |
Product Name: |
6-Chloro-N-methylpyridine-3-sulfonamide |
CAS: |
52480-30-5 |
Synonyms: |
6-chloro-N-methyl-3-pyridinesulfonamide; 6-chloro-N-methylpyridine-3-sulfonamide |
IUPAC Name: | 6-chloro-N-methylpyridine-3-sulfonamide |
Description: | 6-Chloro-N-methylpyridine-3-sulfonamide (CAS# 52480-30-5) is a useful research chemical. |
Molecular Weight: | 206.65 |
Molecular Formula: | C6H7ClN2O2S |
Canonical SMILES: | CNS(=O)(=O)C1=CN=C(C=C1)Cl |
InChI: | InChI=1S/C6H7ClN2O2S/c1-8-12(10,11)5-2-3-6(7)9-4-5/h2-4,8H,1H3 |
InChI Key: | CGCPRMUFYAAJLY-UHFFFAOYSA-N |
LogP: | 2.11480 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2015268961-A1 | MTH1 inhibitors for treatment of cancer | 20140604 |
AU-2015268961-B2 | MTH1 inhibitors for treatment of cancer | 20140604 |
AU-2015268961-B9 | MTH1 inhibitors for treatment of cancer | 20140604 |
AU-2015268962-A1 | MTH1 inhibitors for treatment of inflammatory and autoimmune conditions | 20140604 |
CA-2948601-A1 | Mth1 inhibitors for treatment of inflammatory and autoimmune conditions | 20140604 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.9916763 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.9916763 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 67.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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