Ethyl 3-Oxo-3-(1-Boc-4-piperidyl)propanoate - CAS 479630-08-5
Catalog: |
BB026443 |
Product Name: |
Ethyl 3-Oxo-3-(1-Boc-4-piperidyl)propanoate |
CAS: |
479630-08-5 |
Synonyms: |
4-(3-ethoxy-1,3-dioxopropyl)-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(3-ethoxy-3-oxopropanoyl)piperidine-1-carboxylate |
Description: | Ethyl 3-Oxo-3-(1-Boc-4-piperidyl)propanoate (CAS# 479630-08-5) is a useful research chemical. |
Molecular Weight: | 299.36 |
Molecular Formula: | C15H25NO5 |
Canonical SMILES: | CCOC(=O)CC(=O)C1CCN(CC1)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C15H25NO5/c1-5-20-13(18)10-12(17)11-6-8-16(9-7-11)14(19)21-15(2,3)4/h11H,5-10H2,1-4H3 |
InChI Key: | CWTULLANCDLMGK-UHFFFAOYSA-N |
Boiling Point: | 386.1 °C at 760 mmHg |
Density: | 1.113 g/cm3 |
MDL: | MFCD04115569 |
LogP: | 2.09370 |
Publication Number | Title | Priority Date |
US-2020048242-A1 | Dihydropyrimidine derivatives and uses thereof in the treatment of hbv infection or of hbv-induced diseases | 20180809 |
US-11053235-B2 | Substituted 1,4-dihydropyrimidines for the treatment of HBV infection or HBV-induced diseases | 20180809 |
WO-2020001448-A1 | Dihydropyrimidine derivatives and uses thereof in the treatment of hbv infection or of hbv-induced diseases | 20180626 |
AU-2019296117-A1 | Dihydropyrimidine derivatives and uses thereof in the treatment of HBV infection or of HBV-induced diseases | 20180626 |
CN-112513017-A | Dihydropyrimidine derivatives and their use in the treatment of HBV infection or HBV-induced diseases | 20180626 |
Complexity: | 391 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.1732729 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.1732729 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 72.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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