1-(Methylsulfonyl)-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester - CAS 1382137-67-8
Catalog: |
BB008724 |
Product Name: |
1-(Methylsulfonyl)-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester |
CAS: |
1382137-67-8 |
Synonyms: |
1-methylsulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine; 1-methylsulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine |
IUPAC Name: | 1-methylsulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine |
Description: | 1-(Methylsulfonyl)-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester (CAS# 1382137-67-8 ) is a useful research chemical. |
Molecular Weight: | 287.18 |
Molecular Formula: | C12H22NO4SB |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CCN(CC2)S(=O)(=O)C |
InChI: | InChI=1S/C12H22BNO4S/c1-11(2)12(3,4)18-13(17-11)10-6-8-14(9-7-10)19(5,15)16/h6H,7-9H2,1-5H3 |
InChI Key: | WUYGKJHVVHTRPV-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
Publication Number | Title | Priority Date |
US-10421765-B2 | Tetrahydropyrido[4,3-d]pyrimidine inhibitors of ATR kinase | 20170526 |
US-2018370990-A1 | TETRAHYDROPYRIDO[4,3-d]PYRIMIDINE INHIBITORS OF ATR KINASE | 20170526 |
US-2019367536-A1 | TETRAHYDROPYRIDO[4,3-d]PYRIMIDINE INHIBITORS OF ATR KINASE | 20170526 |
US-10745420-B2 | Tetrahydropyrido[4,3-d]pyrimidine inhibitors of ATR kinase | 20170526 |
US-2018243298-A1 | Trpv3 modulators | 20150402 |
Complexity: | 476 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 287.1362595 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 287.1362595 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 64.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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