Ethyl 1-(2-Fluorobenzyl)pyrazolo[3,4-b]pyridine-3-carboxylate - CAS 256376-59-7
Catalog: |
BB018983 |
Product Name: |
Ethyl 1-(2-Fluorobenzyl)pyrazolo[3,4-b]pyridine-3-carboxylate |
CAS: |
256376-59-7 |
Synonyms: |
1-[(2-fluorophenyl)methyl]-3-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester; ethyl 1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboxylate |
IUPAC Name: | ethyl 1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboxylate |
Description: | Ethyl 1-(2-Fluorobenzyl)pyrazolo[3,4-b]pyridine-3-carboxylate (CAS# 256376-59-7) is used in various studies of stimulators of soluble guanylate cyclase. |
Molecular Weight: | 299.30 |
Molecular Formula: | C16H14FN3O2 |
Canonical SMILES: | CCOC(=O)C1=NN(C2=C1C=CC=N2)CC3=CC=CC=C3F |
InChI: | InChI=1S/C16H14FN3O2/c1-2-22-16(21)14-12-7-5-9-18-15(12)20(19-14)10-11-6-3-4-8-13(11)17/h3-9H,2,10H2,1H3 |
InChI Key: | KZVKXYSMYGMEPB-UHFFFAOYSA-N |
LogP: | 2.79540 |
Publication Number | Title | Priority Date |
EP-3538520-A2 | Sgc stimulators | 20161108 |
US-2020071318-A1 | Sgc stimulators | 20161108 |
WO-2018089330-A2 | Sgc stimulators | 20161108 |
WO-2017121700-A1 | 1,3-disubstituted 1h-pyrazolo[3,4-b]pyridine derivatives and use thereof as stimulators of soluble guanylate cyclase | 20160115 |
WO-2017025981-A1 | Process for the preparation of methyl 4,6-diamino-2-[l-(2-fhiorobenzvr)-lh-pyrazolo i3,4-blpvridin-3-vn-5-pyrimidinyl(methvl)carbamate and its polymorphs thereof | 20150813 |
Complexity: | 396 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.10700486 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.10700486 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 57 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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