Name: Name:2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Brand: Angene
SKU: AG01A0Q7
Rating: 90 (10 reviews)

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

CAS No.:

893726-54-0

Catalog Number:

AG01A0Q7

Molecular Formula:

C17H16ClN5O2S

Molecular Weight:

389.8592

Catalog Number:

AG01A0Q7

Chemical Name:

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

CAS Number:

893726-54-0

Molecular Formula:

C17H16ClN5O2S

Molecular Weight:

389.8592

MDL Number:

MFCD07364301

IUPAC Name:

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

InChI:

InChI=1S/C17H16ClN5O2S/c1-25-14-8-2-11(3-9-14)16-21-22-17(26-10-15(24)20-19)23(16)13-6-4-12(18)5-7-13/h2-9H,10,19H2,1H3,(H,20,24)

InChI Key:

FULJBWUELVZLMD-UHFFFAOYSA-N

SMILES:

NNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)OC

Complexity:

458

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

389.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

389.858g/mol

Monoisotopic Mass:

389.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

120A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8