N-Boc-1-[2-[5-[(3-methyl-3-oxetanyl)methoxy]-1-benzimidazolyl]-8-quinolyl]-4-piperidinamine - CAS 816463-40-8
Catalog: |
BB036690 |
Product Name: |
N-Boc-1-[2-[5-[(3-methyl-3-oxetanyl)methoxy]-1-benzimidazolyl]-8-quinolyl]-4-piperidinamine |
CAS: |
816463-40-8 |
Synonyms: |
N-[1-[2-[5-[(3-methyl-3-oxetanyl)methoxy]-1-benzimidazolyl]-8-quinolinyl]-4-piperidinyl]carbamic acid tert-butyl ester; tert-butyl N-[1-[2-[5-[(3-methyloxetan-3-yl)methoxy]benzimidazol-1-yl]quinolin-8-yl]piperidin-4-yl]carbamate |
IUPAC Name: | tert-butyl N-[1-[2-[5-[(3-methyloxetan-3-yl)methoxy]benzimidazol-1-yl]quinolin-8-yl]piperidin-4-yl]carbamate |
Description: | N-Boc-1-[2-[5-[(3-methyl-3-oxetanyl)methoxy]-1-benzimidazolyl]-8-quinolyl]-4-piperidinamine (CAS# 816463-40-8 ) is a useful research chemical. |
Molecular Weight: | 543.66 |
Molecular Formula: | C31H37N5O4 |
Canonical SMILES: | CC1(COC1)COC2=CC3=C(C=C2)N(C=N3)C4=NC5=C(C=CC=C5N6CCC(CC6)NC(=O)OC(C)(C)C)C=C4 |
InChI: | InChI=1S/C31H37N5O4/c1-30(2,3)40-29(37)33-22-12-14-35(15-13-22)26-7-5-6-21-8-11-27(34-28(21)26)36-20-32-24-16-23(9-10-25(24)36)39-19-31(4)17-38-18-31/h5-11,16,20,22H,12-15,17-19H2,1-4H3,(H,33,37) |
InChI Key: | XTEISTUNIRPWMF-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
CN-107382983-B | Synthesis method of medicine for treating leukemia | 20170824 |
CN-107382984-B | Preparation method of medicine for treating leukemia | 20170824 |
AU-2004249511-A1 | Processes for the preparation of 1-[(benzoimidazole-1yl) quinolin-8-yl] piperidin-4-ylamine derivatives | 20030624 |
AU-2004249511-B2 | Processes for the preparation of 1-[(benzoimidazole-1yl) quinolin-8-yl] piperidin-4-ylamine derivatives | 20030624 |
EP-1641780-A1 | Processes for the preparation of 1- [(benzoimidazole-1yl) quinolin-8-yl] piperidin-4-ylamine derivatives | 20030624 |
Complexity: | 870 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 543.28455468 |
Formal Charge: | 0 |
Heavy Atom Count: | 40 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 543.28455468 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 90.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.3 |
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Quinoline/Isoquinoline
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