1-Methyl-2-oxo-1,2-dihydropyridine-4-boronic Acid Pinacol Ester - CAS 1160790-84-0
Catalog: |
BB003706 |
Product Name: |
1-Methyl-2-oxo-1,2-dihydropyridine-4-boronic Acid Pinacol Ester |
CAS: |
1160790-84-0 |
Synonyms: |
1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinone; 1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one |
IUPAC Name: | 1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one |
Description: | 1-Methyl-2-oxo-1,2-dihydropyridine-4-boronic Acid Pinacol Ester (CAS# 1160790-84-0 ) is a useful research chemical. |
Molecular Weight: | 235.09 |
Molecular Formula: | C12H18NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=O)N(C=C2)C |
InChI: | InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-6-7-14(5)10(15)8-9/h6-8H,1-5H3 |
InChI Key: | AVJRGCKNVZTWQH-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD12032569 |
LogP: | 0.68450 |
Publication Number | Title | Priority Date |
US-2020360353-A1 | Macrocyclic azolopyridine derivatives as eed and prc2 modulators | 20190315 |
TW-202102495-A | Macrocyclic azolopyridine derivatives as eed and prc2 modulators | 20190315 |
US-10973805-B2 | Macrocyclic azolopyridine derivatives as EED and PRC2 modulators | 20190315 |
WO-2020163541-A1 | Methods and compositions for modulating splicing | 20190205 |
CN-111918863-A | Heterocyclic compounds | 20180329 |
Complexity: | 396 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.1379736 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.1379736 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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