3-Amino-5-(4-chlorophenyl)-2-thiophenecarboxylic Acid - CAS 187949-86-6
Catalog: |
BB014475 |
Product Name: |
3-Amino-5-(4-chlorophenyl)-2-thiophenecarboxylic Acid |
CAS: |
187949-86-6 |
Synonyms: |
3-amino-5-(4-chlorophenyl)-2-thiophenecarboxylic acid; 3-amino-5-(4-chlorophenyl)thiophene-2-carboxylic acid |
IUPAC Name: | 3-amino-5-(4-chlorophenyl)thiophene-2-carboxylic acid |
Description: | 3-Amino-5-(4-chlorophenyl)-2-thiophenecarboxylic Acid (CAS# 187949-86-6) is a useful research chemical. |
Molecular Weight: | 253.70 |
Molecular Formula: | C11H8ClNO2S |
Canonical SMILES: | C1=CC(=CC=C1C2=CC(=C(S2)C(=O)O)N)Cl |
InChI: | InChI=1S/C11H8ClNO2S/c12-7-3-1-6(2-4-7)9-5-8(13)10(16-9)11(14)15/h1-5H,13H2,(H,14,15) |
InChI Key: | HTTXGCKIKMLVMR-UHFFFAOYSA-N |
Boiling Point: | 507.261 ℃ at 760 mmHg |
Density: | 1.483 g/cm3 |
MDL: | MFCD09909681 |
LogP: | 3.93010 |
Publication Number | Title | Priority Date |
WO-2014111666-A1 | Thieno[3,2-d]pyrimidin-4(3h)-one derivatives and the preparation and pharmaceutical uses thereof | 20130118 |
EP-2403860-B1 | Phosphothiophene and phosphothiazole as hcv polymerase inhibitors | 20090304 |
WO-2010101967-A2 | Phosphothiophene and phosphothiazole hcv polymerase inhibitors | 20090304 |
CN-102099360-A | Hydroxy substituted thieno pyrimidinones as melanin concentrating hormone receptor-1 antagonists | 20080529 |
CN-101687882-A | Non-basic melanin concentrating hormone receptor body-1 antagonist | 20070425 |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.9964274 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.9964274 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 91.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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