N-tert-Butyl 5-Chloro-2-thiophenesulfonamide - CAS 155731-14-9
Catalog: |
BB011147 |
Product Name: |
N-tert-Butyl 5-Chloro-2-thiophenesulfonamide |
CAS: |
155731-14-9 |
Synonyms: |
N-tert-butyl-5-chloro-2-thiophenesulfonamide; N-tert-butyl-5-chlorothiophene-2-sulfonamide |
IUPAC Name: | N-tert-butyl-5-chlorothiophene-2-sulfonamide |
Description: | N-tert-Butyl 5-Chloro-2-thiophenesulfonamide (CAS# 155731-14-9) is a useful research chemical. |
Molecular Weight: | 253.77 |
Molecular Formula: | C8H12ClNO2S2 |
Canonical SMILES: | CC(C)(C)NS(=O)(=O)C1=CC=C(S1)Cl |
InChI: | InChI=1S/C8H12ClNO2S2/c1-8(2,3)10-14(11,12)7-5-4-6(9)13-7/h4-5,10H,1-3H3 |
InChI Key: | VPZSRWXWBIVADA-UHFFFAOYSA-N |
Boiling Point: | 349.1 °C at 760 mmHg |
Density: | 1.328 g/cm3 |
MDL: | MFCD05086586 |
LogP: | 3.95000 |
Publication Number | Title | Priority Date |
WO-2020102576-A1 | Compounds and compositions for treating conditions associated with nlrp activity | 20181116 |
TW-202033504-A | Compounds and compositions for treating conditions associated with nlrp activity | 20181116 |
EP-3880659-A1 | Compounds and compositions for treating conditions associated with nlrp activity | 20181116 |
WO-2020102096-A1 | Compounds and compositions for treating conditions associated with nlrp activity | 20181113 |
TW-202031647-A | Compounds and compositions for treating conditions associated with nlrp activity | 20181113 |
Complexity: | 291 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.9997987 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.9997987 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 82.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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