Ethyl 2-(Boc-amino)thiazole-5-carboxylate - CAS 302964-01-8
Catalog: |
BB020536 |
Product Name: |
Ethyl 2-(Boc-amino)thiazole-5-carboxylate |
CAS: |
302964-01-8 |
Synonyms: |
2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester; ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazole-5-carboxylate |
IUPAC Name: | ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazole-5-carboxylate |
Description: | Ethyl 2-(Boc-amino)thiazole-5-carboxylate (CAS# 302964-01-8) is a useful research chemical. |
Molecular Weight: | 272.32 |
Molecular Formula: | C11H16N2O4S |
Canonical SMILES: | CCOC(=O)C1=CN=C(S1)NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C11H16N2O4S/c1-5-16-8(14)7-6-12-9(18-7)13-10(15)17-11(2,3)4/h6H,5H2,1-4H3,(H,12,13,15) |
InChI Key: | HFYFUEBSUSRJIV-UHFFFAOYSA-N |
Density: | 1.263 g/cm3 |
MDL: | MFCD09908086 |
LogP: | 2.73980 |
Publication Number | Title | Priority Date |
KR-20200140200-A | Protein kinase inhibitor and use thereof | 20190605 |
CN-109265455-B | Preparation method of dasatinib | 20181109 |
CN-113166137-A | O-glycoprotein-2-acetamido-2-deoxy-3-D-glucopyranosidase inhibitors | 20180919 |
US-2019292177-A1 | An improved process for the preparation of dasatinib polymorph | 20161201 |
WO-2018100585-A1 | An improved process for the preparation of dasatinib polymorph | 20161201 |
PMID | Publication Date | Title | Journal |
22412626 | 20120301 | Ethyl 2-[(tert-but-oxy-carbon-yl)amino]-thia-zole-5-carboxyl-ate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 317 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 272.08307817 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 272.08307817 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 106 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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