2-Boc-8-(Hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline - CAS 1204765-84-3
Catalog: |
BB004885 |
Product Name: |
2-Boc-8-(Hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline |
CAS: |
1204765-84-3 |
Synonyms: |
8-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester; tert-butyl 8-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate |
IUPAC Name: | tert-butyl 8-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate |
Description: | 2-Boc-8-(Hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline (CAS# 1204765-84-3 ) is a useful research chemical. |
Molecular Weight: | 263.33 |
Molecular Formula: | C15H21NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2=C(C1)C(=CC=C2)CO |
InChI: | InChI=1S/C15H21NO3/c1-15(2,3)19-14(18)16-8-7-11-5-4-6-12(10-17)13(11)9-16/h4-6,17H,7-10H2,1-3H3 |
InChI Key: | JUVATTRMXMJVOM-UHFFFAOYSA-N |
LogP: | 2.41000 |
Publication Number | Title | Priority Date |
TW-201908310-A | Compound | 20170511 |
WO-2018205948-A1 | Compounds | 20170511 |
EP-3472147-B1 | Azabenzimidazole derivatives as pi3k beta inhibitors | 20160616 |
US-2019263804-A1 | Azabenzimidazole derivatives as pi3k beta inhibitors | 20160616 |
WO-2017216293-A1 | Azabenzimidazole derivatives as pi3k beta inhibitors | 20160616 |
Complexity: | 324 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.15214353 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.15214353 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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