Name: Name:2-butyl-1-({4-[2-(1H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)-1H-1,3-benzodiazole
Brand: Angene
SKU: AG01A2SO
Rating: 90 (10 reviews)

2-butyl-1-({4-[2-(1H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)-1H-1,3-benzodiazole

CAS No.:

133052-87-6

Catalog Number:

AG01A2SO

Molecular Formula:

C25H24N6

Molecular Weight:

408.4983

Catalog Number:

AG01A2SO

Chemical Name:

2-butyl-1-({4-[2-(1H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)-1H-1,3-benzodiazole

CAS Number:

133052-87-6

Molecular Formula:

C25H24N6

Molecular Weight:

408.4983

MDL Number:

MFCD00896760

IUPAC Name:

2-butyl-1-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole

InChI:

InChI=1S/C25H24N6/c1-2-3-12-24-26-22-10-6-7-11-23(22)31(24)17-18-13-15-19(16-14-18)20-8-4-5-9-21(20)25-27-29-30-28-25/h4-11,13-16H,2-3,12,17H2,1H3,(H,27,28,29,30)

InChI Key:

IFVAHIKNRDQTNV-UHFFFAOYSA-N

SMILES:

CCCCc1nc2c(n1Cc1ccc(cc1)c1ccccc1c1[nH]nnn1)cccc2

Complexity:

550

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

408.206g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

408.509g/mol

Monoisotopic Mass:

408.206g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.6