N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine

C13H8BrCl2N5 — CID 71733975

IUPACN-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine
SMILESClc1ccc(-n2nnnc2Nc2ccc(Cl)cc2Br)cc1
InChIInChI=1S/C13H8BrCl2N5/c14-11-7-9(16)3-6-12(11)17-13-18-19-20-21(13)10-4-1-8(15)2-5-10/h1-7H,(H,17,18,20)
InChIKeyMOSZZGOJLFHNIG-UHFFFAOYSA-N
MW385.05 g/mol
LogP4.48
Rot. Bonds3

About N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine

N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine (PubChem CID 71733975) has the molecular formula C13H8BrCl2N5 and a molecular weight of 385.05 g/mol. Its IUPAC name is N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine.

Molecular Properties

Compound NameN-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine
PubChem CID71733975
Molecular FormulaC13H8BrCl2N5
Molecular Weight385.05 g/mol
Exact Mass382.93
IUPAC NameN-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine
SMILESClc1ccc(-n2nnnc2Nc2ccc(Cl)cc2Br)cc1
InChIInChI=1S/C13H8BrCl2N5/c14-11-7-9(16)3-6-12(11)17-13-18-19-20-21(13)10-4-1-8(15)2-5-10/h1-7H,(H,17,18,20)
InChIKeyMOSZZGOJLFHNIG-UHFFFAOYSA-N
XLogP4.48
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.05
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(4-chlorophenyl)tetrazol-5-yl]hydrazine
CID 131053219
N-(2-bromophenyl)-1-(4-methoxyphenyl)tetrazol-5-amine
CID 162646866
1-(4-chlorophenyl)-N,N-dimethyltetrazol-5-amine
CID 539378
1-(4-chlorophenyl)-5-(3,4-dichlorophenyl)tetrazole
CID 2799603
N-(2-bromo-4-chlorophenyl)-1-ethyl-4-methylimidazol-2-amine
CID 106577587
2-[1-(4-bromo-3-chlorophenyl)tetrazol-5-yl]-4-chloroaniline
CID 107616313
2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-N-(2,4-dichlorophenyl)acetamide
CID 1348349
N-(2-bromo-4-chlorophenyl)-5-iodopyrimidin-2-amine
CID 116649026
1-[1-(4-chlorophenyl)tetrazol-5-yl]-N-methylmethanamine
CID 62736070
2-[1-(4-bromo-3-fluorophenyl)tetrazol-5-yl]-4-chloroaniline
CID 65436622
2-bromo-4-chloro-N-(2,2,2-trifluoroethyl)aniline
CID 81270991
N-(4-bromo-2-fluorophenyl)-2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylacetamide
CID 2610371

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine?
The IUPAC name of N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine (CID 71733975) is N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine.
What is the SMILES notation for N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine?
The canonical SMILES for N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine is Clc1ccc(-n2nnnc2Nc2ccc(Cl)cc2Br)cc1.
What is the InChIKey of N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine?
The InChIKey is MOSZZGOJLFHNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrCl2N5/c14-11-7-9(16)3-6-12(11)17-13-18-19-20-21(13)10-4-1-8(15)2-5-10/h1-7H,(H,17,18,20).
What are the key properties of N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine?
N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine has a molecular weight of 385.05 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-chlorophenyl)-1-(4-chlorophenyl)tetrazol-5-amine is sourced from PubChem (CID 71733975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).