Basic information
- CAS
120824-08-0- Standard SMILES
O=C(O)COc1ccc(CCNS(=O)(=O)c2ccccc2)s1- InChIKey
ISSKMEQROMFEHL-UHFFFAOYSA-N- Molecular formula
- C14H15NO5S2
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.03916493
Overview
Linotroban is a small molecule drug. Linotroban has a monoisotopic molecular weight of 341.04 Da.
Names & identifiers
- Preferred name
- Linotroban
- IUPAC
- 2-[5-[2-(benzenesulfonamido)ethyl]thiophen-2-yl]oxyacetic acid
- English name
- linotroban
- Molecular formula
- C14H15NO5S2
- Molecular weight
- 341.4
Names & synonyms
Linotroban120824-08-0DTXSID40461036O2O36OL57DTXCID2026103linotrobanumRefChem:924806HN-11550Linotroban [INN]2-[5-[2-(benzenesulfonamido)ethyl]thiophen-2-yl]oxyacetic acidHN-11500HN11500
Show more names
Acetic acid, 2-[[5-[2-[(phenylsulfonyl)amino]ethyl]-2-thienyl]oxy]-
2-((5-(2-(phenylsulfonamido)ethyl)thiophen-2-yl)oxy)acetic acidNCGC00160350-01141443-73-4((5-(2-Benzenesulfonamidoethyl)-2-thienyl)oxy)acetic acidUNII-6O2O36OL57HN 11500CL 87-15-01SCHEMBL635680
Database identifiers
- CAS
120824-08-0、141443-73-4- PubChem CID
- 65940
- DTXSID
DTXSID4046103- ChEMBL
CHEMBL1742437- UNII
- 6O2O36OL57
- Nikkaji
- J550.686G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 456
Physicochemical properties
- Boiling point
- 558.8 · 558.8±60.0 °C(Predicted)
- Density
- 1.411 · 1.411±0.06 g/cm3(Predicted)
- pka
- 2.99 · 2.99±0.10(Predicted)
- FDA UNII
- 6 O2O36OL57 · 6O2O36OL57
Chemistry & industry
Applications
UsesLinotroban (HN11500), a Sulotroban (HY-158332) derivative, is an orally active, potent non-prostanoid thromboxane receptor antagonist (TXRA) with a strong antiplatelet profile. Linotroban is used as antithrombotic agent[1].
Suppliers5 total
北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…