Home Aminos 2,2,2-trifluoroethyl N-{4-[cyclohexyl(methyl)amino]-3-fluorophenyl}carbamate hydrochloride

2,2,2-trifluoroethyl N-{4-[cyclohexyl(methyl)amino]-3-fluorophenyl}carbamate hydrochloride

CAS No.:
1315366-48-3
Catalog Number:
AG01AIZ4
Molecular Formula:
C16H21ClF4N2O2
Molecular Weight:
384.7968
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Product Description
Catalog Number:
AG01AIZ4
Chemical Name:
2,2,2-trifluoroethyl N-{4-[cyclohexyl(methyl)amino]-3-fluorophenyl}carbamate hydrochloride
CAS Number:
1315366-48-3
Molecular Formula:
C16H21ClF4N2O2
Molecular Weight:
384.7968
MDL Number:
MFCD19381982
IUPAC Name:
2,2,2-trifluoroethyl N-[4-[cyclohexyl(methyl)amino]-3-fluorophenyl]carbamate;hydrochloride
InChI:
InChI=1S/C16H20F4N2O2.ClH/c1-22(12-5-3-2-4-6-12)14-8-7-11(9-13(14)17)21-15(23)24-10-16(18,19)20;/h7-9,12H,2-6,10H2,1H3,(H,21,23);1H
InChI Key:
CJVRSYUQEDQCOG-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(c(c1)F)N(C1CCCCC1)C)OCC(F)(F)F.Cl
Properties
Complexity:
413  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.123g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
384.8g/mol
Monoisotopic Mass:
384.123g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties