Name: Name:5-Benzoyl-2-(2,4,6-trichlorophenyl)-1,2-dihydro-3H-1,2,4-triazol-3-one
Brand: Angene
SKU: AG01F4WN
Rating: 90 (10 reviews)

5-Benzoyl-2-(2,4,6-trichlorophenyl)-1,2-dihydro-3H-1,2,4-triazol-3-one

CAS No.:

1000575-15-4

Catalog Number:

AG01F4WN

Molecular Formula:

C15H8Cl3N3O2

Molecular Weight:

368.6019

Catalog Number:

AG01F4WN

Chemical Name:

5-Benzoyl-2-(2,4,6-trichlorophenyl)-1,2-dihydro-3H-1,2,4-triazol-3-one

CAS Number:

1000575-15-4

Molecular Formula:

C15H8Cl3N3O2

Molecular Weight:

368.6019

MDL Number:

MFCD09954987

IUPAC Name:

5-benzoyl-2-(2,4,6-trichlorophenyl)-4H-1,2,4-triazol-3-one

InChI:

InChI=1S/C15H8Cl3N3O2/c16-9-6-10(17)12(11(18)7-9)21-15(23)19-14(20-21)13(22)8-4-2-1-3-5-8/h1-7H,(H,19,20,23)

InChI Key:

XIROJUYSUUWXIX-UHFFFAOYSA-N

SMILES:

Clc1cc(Cl)c(c(c1)Cl)n1nc([nH]c1=O)C(=O)c1ccccc1

Complexity:

510

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

366.968g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

368.598g/mol

Monoisotopic Mass:

366.968g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4