SCHEMBL1557228

2-[4-[4-(3,5-diphenyl-1H-tetrazol-2-yl)-3-methoxyphenyl]-2-methoxyphenyl]-3,5-diphenyl-1H-tetrazole;dihydrochloride

CAS: 101329-54-8

Molecular Formula	`C40H36Cl2N8O2`
Molecular Weight	731.7 g/mol
Topological Polar Surface Area	80.2 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	9
Exact Mass	730.2338
Heavy Atoms	52
Complexity	1060.0

Chemical Identifiers

CAS Number	101329-54-8
SMILES	`COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N3NC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)OC)N6NC(=NN6C7=CC=CC=C7)C8=CC=CC=C8.Cl.Cl`
InChIKey	`RCEHREKDVGHYAM-UHFFFAOYSA-N`

📖 Product Overview

SCHEMBL1557228 (CAS: 101329-54-8) is a chemical compound with molecular formula C40H36Cl2N8O2 and molecular weight 731.7 g/mol. Its IUPAC systematic name is 2-[4-[4-(3,5-diphenyl-1H-tetrazol-2-yl)-3-methoxyphenyl]-2-methoxyphenyl]-3,5-diphenyl-1H-tetrazole;dihydrochloride. Topological Polar Surface Area 80.2 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 8 Rotatable Bonds 9 Exact Mass 730.2338 Heavy Atoms 52 Complexity 1060.0 InChI Key: RCEHREKDVGHYAM-UHFFFAOYSA-N. SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N3NC(=NN3C4=CC=CC=C4)C5=CC=CC=C5)OC)N6NC(=NN6C7=CC=CC=C7)C8=CC=CC=C8.Cl.Cl.

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