N-Boc-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carbaldehyde - CAS 203663-30-3
Catalog: |
BB015861 |
Product Name: |
N-Boc-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carbaldehyde |
CAS: |
203663-30-3 |
Synonyms: |
2-formyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid tert-butyl ester; tert-butyl 2-formyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate |
IUPAC Name: | tert-butyl 2-formyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate |
Description: | N-Boc-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-2-carbaldehyde (CAS# 203663-30-3) is a useful research chemical compound. |
Molecular Weight: | 267.34 |
Molecular Formula: | C13H17NO3S |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2=C(C1)SC(=C2)C=O |
InChI: | InChI=1S/C13H17NO3S/c1-13(2,3)17-12(16)14-5-4-9-6-10(8-15)18-11(9)7-14/h6,8H,4-5,7H2,1-3H3 |
InChI Key: | ARIXDMKUEBQESN-UHFFFAOYSA-N |
LogP: | 2.79170 |
Publication Number | Title | Priority Date |
WO-2016206651-A1 | 2-substituted benzimidazole-4-carboxamide compound and preparation method and use thereof | 20150626 |
CN-107922430-B | 2-substituted benzimidazole-4-formamide compound and preparation method and application thereof | 20150626 |
EP-1740579-B1 | Tricyclic pyrazole kinase inhibitors | 20040324 |
JP-2007530581-A | Tricyclic pyrazole kinase inhibitor | 20040324 |
JP-5136929-B2 | Tricyclic pyrazole kinase inhibitor | 20040324 |
Complexity: | 340 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.09291458 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.09291458 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 74.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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