cis-3-(Cbz-amino)cyclohexanamine - CAS 1261225-45-9
Catalog: |
BB006448 |
Product Name: |
cis-3-(Cbz-amino)cyclohexanamine |
CAS: |
1261225-45-9 |
Synonyms: |
N-[(1R,3S)-3-aminocyclohexyl]carbamic acid (phenylmethyl) ester; benzyl N-[(1R,3S)-3-aminocyclohexyl]carbamate |
IUPAC Name: | benzyl N-[(1R,3S)-3-aminocyclohexyl]carbamate |
Description: | cis-3-(Cbz-amino)cyclohexanamine (CAS# 1261225-45-9) is a useful research chemical. |
Molecular Weight: | 248.32 |
Molecular Formula: | C14H20N2O2 |
Canonical SMILES: | C1CC(CC(C1)NC(=O)OCC2=CC=CC=C2)N |
InChI: | InChI=1S/C14H20N2O2/c15-12-7-4-8-13(9-12)16-14(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-10,15H2,(H,16,17)/t12-,13+/m0/s1 |
InChI Key: | NFWZARAFTINKJK-QWHCGFSZSA-N |
LogP: | 3.08740 |
Publication Number | Title | Priority Date |
WO-2017089518-A1 | Heterocyclic indoles for use in influenza virus infection | 20151127 |
US-10597390-B2 | Indoles for use in influenza virus infection | 20140808 |
US-2017226102-A1 | Indoles for use in influenza virus infection | 20140808 |
EP-2493877-B1 | Pyrimidine compounds as delta opioid receptor modulators | 20091030 |
Complexity: | 265 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.152477885 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.152477885 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 64.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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