Name: Name:({1-[(2-chlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methyl)(methyl)amine
Brand: Angene
SKU: AG019NXC
Rating: 90 (10 reviews)

({1-[(2-chlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methyl)(methyl)amine

CAS No.:

956262-06-9

Catalog Number:

AG019NXC

Molecular Formula:

C18H18ClN3

Molecular Weight:

311.8086

Catalog Number:

AG019NXC

Chemical Name:

({1-[(2-chlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl}methyl)(methyl)amine

CAS Number:

956262-06-9

Molecular Formula:

C18H18ClN3

Molecular Weight:

311.8086

MDL Number:

MFCD06380391

IUPAC Name:

1-[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]-N-methylmethanamine

InChI:

InChI=1S/C18H18ClN3/c1-20-11-16-13-22(12-15-9-5-6-10-17(15)19)21-18(16)14-7-3-2-4-8-14/h2-10,13,20H,11-12H2,1H3

InChI Key:

MYSYVLIMJRJIFS-UHFFFAOYSA-N

SMILES:

CNCc1cn(nc1c1ccccc1)Cc1ccccc1Cl

Complexity:

332

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.119g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.813g/mol

Monoisotopic Mass:

311.119g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5