N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine

C8H4BrCl2N3S — CID 107615026

IUPACN-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
SMILESClc1cc(Nc2nsnc2Cl)ccc1Br
InChIInChI=1S/C8H4BrCl2N3S/c9-5-2-1-4(3-6(5)10)12-8-7(11)13-15-14-8/h1-3H,(H,12,14)
InChIKeyRHRZZAPRINEBKD-UHFFFAOYSA-N
MW325.02 g/mol
LogP4.35
Rot. Bonds2

About N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine

N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine (PubChem CID 107615026) has the molecular formula C8H4BrCl2N3S and a molecular weight of 325.02 g/mol. Its IUPAC name is N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine.

Molecular Properties

Compound NameN-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
PubChem CID107615026
Molecular FormulaC8H4BrCl2N3S
Molecular Weight325.02 g/mol
Exact Mass322.87
IUPAC NameN-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
SMILESClc1cc(Nc2nsnc2Cl)ccc1Br
InChIInChI=1S/C8H4BrCl2N3S/c9-5-2-1-4(3-6(5)10)12-8-7(11)13-15-14-8/h1-3H,(H,12,14)
InChIKeyRHRZZAPRINEBKD-UHFFFAOYSA-N
XLogP4.35
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.02
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-bromonaphthalen-2-yl)-4-chloro-1,2,5-thiadiazol-3-amine
CID 81260117
5-bromo-N-(4-bromo-3-chlorophenyl)-1,3,4-thiadiazol-2-amine
CID 107615031
N-(4-bromo-2,3-dichlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
CID 107792312
N-(4-bromo-3-chlorophenyl)-3,5,6-trifluoropyridin-2-amine
CID 114072741
N-(4-bromo-3-chlorophenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 107614115
5-bromo-N-(4-bromo-3-chlorophenyl)-3-methylpyridin-2-amine
CID 107616385
N-(2-bromo-4-iodophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
CID 130499509
N-(4-bromo-3-chlorophenyl)-2-chloro-5-fluoropyrimidin-4-amine
CID 107614995
4-N-(4-bromo-3-chlorophenyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 107617897
N-(2-bromo-4-fluorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine
CID 43808120
4-N-(4-bromo-3-chlorophenyl)-2-N-methylpyridine-2,4-diamine
CID 107617821
5-bromo-N-(4-bromo-3-chlorophenyl)pyridin-3-amine
CID 107615000

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine?
The IUPAC name of N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine (CID 107615026) is N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine.
What is the SMILES notation for N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine?
The canonical SMILES for N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine is Clc1cc(Nc2nsnc2Cl)ccc1Br.
What is the InChIKey of N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine?
The InChIKey is RHRZZAPRINEBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4BrCl2N3S/c9-5-2-1-4(3-6(5)10)12-8-7(11)13-15-14-8/h1-3H,(H,12,14).
What are the key properties of N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine?
N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine has a molecular weight of 325.02 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-chlorophenyl)-4-chloro-1,2,5-thiadiazol-3-amine is sourced from PubChem (CID 107615026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).