Name: Name:2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Brand: Angene
SKU: AG01A0PM
Rating: 90 (10 reviews)

2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

CAS No.:

93300-22-2

Catalog Number:

AG01A0PM

Molecular Formula:

C16H14ClN5OS

Molecular Weight:

359.8333

Catalog Number:

AG01A0PM

Chemical Name:

2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

CAS Number:

93300-22-2

Molecular Formula:

C16H14ClN5OS

Molecular Weight:

359.8333

MDL Number:

MFCD01164037

IUPAC Name:

2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide

InChI:

InChI=1S/C16H14ClN5OS/c17-12-8-6-11(7-9-12)15-20-21-16(24-10-14(23)19-18)22(15)13-4-2-1-3-5-13/h1-9H,10,18H2,(H,19,23)

InChI Key:

MIWNDEFECISAKR-UHFFFAOYSA-N

SMILES:

NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl

Complexity:

415

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

359.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

359.832g/mol

Monoisotopic Mass:

359.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

111A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8