1-Benzhydryl-3-(trifluoromethyl)-3-azetidinol - CAS 848192-92-7
Catalog: |
BB037322 |
Product Name: |
1-Benzhydryl-3-(trifluoromethyl)-3-azetidinol |
CAS: |
848192-92-7 |
Synonyms: |
1-(diphenylmethyl)-3-(trifluoromethyl)-3-azetidinol; 1-benzhydryl-3-(trifluoromethyl)azetidin-3-ol |
IUPAC Name: | 1-benzhydryl-3-(trifluoromethyl)azetidin-3-ol |
Description: | 1-Benzhydryl-3-(trifluoromethyl)-3-azetidinol (CAS# 848192-92-7) is a useful research chemical. |
Molecular Weight: | 307.31 |
Molecular Formula: | C17H16F3NO |
Canonical SMILES: | C1C(CN1C(C2=CC=CC=C2)C3=CC=CC=C3)(C(F)(F)F)O |
InChI: | InChI=1S/C17H16F3NO/c18-17(19,20)16(22)11-21(12-16)15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,22H,11-12H2 |
InChI Key: | WGGVLWJKPPOWCR-UHFFFAOYSA-N |
MDL: | MFCD18839240 |
LogP: | 3.32290 |
Publication Number | Title | Priority Date |
AU-2016246802-A1 | Boron-containing small molecules as antiprotozoal agents | 20150409 |
CA-2979891-A1 | Boron-containing small molecules as antiprotozoal agents | 20150409 |
EP-3280717-A1 | Boron-containing small molecules as antiprotozoal agents | 20150409 |
JP-2018514519-A | Boron-containing small molecules as antiprotozoal agents | 20150409 |
KR-20170136570-A | Boron-containing small molecules as antigens | 20150409 |
Complexity: | 349 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 307.11839862 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 307.11839862 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 23.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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