Ethyl 5-Boc-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate - CAS 1053656-51-1
Catalog: |
BB001624 |
Product Name: |
Ethyl 5-Boc-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate |
CAS: |
1053656-51-1 |
Synonyms: |
6,7-dihydro-4H-thiazolo[5,4-c]pyridine-2,5-dicarboxylic acid O5-tert-butyl ester O2-ethyl ester; 5-O-tert-butyl 2-O-ethyl 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2,5-dicarboxylate |
IUPAC Name: | 5-O-tert-butyl 2-O-ethyl 6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2,5-dicarboxylate |
Description: | Ethyl 5-Boc-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxylate (CAS# 1053656-51-1) is a useful research chemical. |
Molecular Weight: | 312.38 |
Molecular Formula: | C14H20N2O4S |
Canonical SMILES: | CCOC(=O)C1=NC2=C(S1)CN(CC2)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C14H20N2O4S/c1-5-19-12(17)11-15-9-6-7-16(8-10(9)21-11)13(18)20-14(2,3)4/h5-8H2,1-4H3 |
InChI Key: | ZCUHIQJCEMMTLK-UHFFFAOYSA-N |
Density: | 1.241 g/cm3 |
LogP: | 2.55090 |
Publication Number | Title | Priority Date |
CA-3047986-A1 | Benzooxazole derivatives as immunomodulators | 20161222 |
EP-3558973-A1 | Pyridine derivatives as immunomodulators | 20161222 |
EP-3558985-A1 | Benzooxazole derivatives as immunomodulators | 20161222 |
US-10308644-B2 | Heterocyclic compounds as immunomodulators | 20161222 |
US-2018179179-A1 | Heterocyclic compounds as immunomodulators | 20161222 |
Complexity: | 410 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 312.1143783 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 312.1143783 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 97 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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