LG 82-4-01
Basic information
- CAS
91505-19-0- Standard SMILES
Cl.O=C(O)c1cc(Cl)c(OCCn2ccnc2)s1- InChIKey
GPQCCNMZXMIFRS-UHFFFAOYSA-N- Molecular formula
- C10H10Cl2N2O3S
- Average molar mass
- 309.17 g/mol
- Monoisotopic mass
- 307.9789187
Overview
structure given in first source
Names & identifiers
- Preferred name
- LG 82-4-01
- IUPAC
- 4-chloro-5-(2-imidazol-1-ylethoxy)thiophene-2-carboxylic acid;hydrochloride
- English name
- LG 82-4-01
- Molecular formula
- C10H9ClN2O3S.ClH
- Molecular weight
- 309.172
Names & synonyms
91505-19-0LG 82-4-01Lg 82401DTXSID802386022-Thiophenecarboxylic acid, 4-chloro-5-(2-(1H-imidazol-1-yl)ethoxy)-, monohydrochlorideRefChem:153257DTXCID901610935-(2-(1-Imidazolyl)ethoxy)-4-chlorothiophene-2-carboxylic acid2-Thiophenecarboxylicacid, 4-chloro-5-[2-(1H-imidazol-1-yl)ethoxy]-, hydrochloride (1:1)4-chloro-5-(2-imidazol-1-ylethoxy)thiophene-2-carboxylic acid;hydrochlorideorb1702022SCHEMBL10855851
Show more names
L82401LG 82401,LG 82 4 01
AKOS040747080DA-64946HY-129614CS-0106956T257104-chloro-5-(2-(1-imidazolyl)-ethoxy)-thiophene-2-carboxylic acid hydrochloride4-Chloro-5-[2-(1H-imidazol-1-yl)ethoxy]thiophene-2-carboxylic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
91505-19-0- PubChem CID
- 124651
- DTXSID
DTXSID80238602
Properties
Computed structural properties
- Topological polar surface area
- 92.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Chemistry & industry
Applications
DescriptionLG 82-4-01 is a thromboxane (TX) synthetase inhibitor.
UsesLG 82-4-01 is a thromboxane (TX) synthetase specific inhibitor, with an IC50 of 1.3 μM[1].
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…