1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(4-methoxyphenyl)thiosemicarbazide

Base Information

• Chemical Name: 1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(4-methoxyphenyl)thiosemicarbazide
• CAS No.: 111897-72-4
• Molecular Formula: C19H21 N7 O4 S
• Molecular Weight: 443.4795
• DSSTox Substance ID: DTXSID80149764
• Wikidata: Q83015628
• Mol file: 111897-72-4.mol

Synonyms:1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(4-methoxyphenyl)thiosemicarbazide;2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-(((4-methoxyphenyl)amino)thioxomethyl)hydrazide;111897-72-4;DTXSID80149764;LS-149057

Chemical Property of 1-(5-(3,4-Dimethoxyphenyl)tetrazol-2-ylacetyl)-4-(4-methoxyphenyl)thiosemicarbazide

Chemical Property:

• Density: 1.4g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 443.13757335
• Heavy Atom Count: 31
• Complexity: 594

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)NC(=S)NNC(=O)CN2N=C(N=N2)C3=CC(=C(C=C3)OC)OC

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