N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine

C10H8BrClN2S — CID 83155520

IUPACN-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine
SMILESCc1ccc(Br)c(Nc2nc(Cl)cs2)c1
InChIInChI=1S/C10H8BrClN2S/c1-6-2-3-7(11)8(4-6)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14)
InChIKeyYASQZQMLNMPWDS-UHFFFAOYSA-N
MW303.61 g/mol
LogP4.61
Rot. Bonds2

About N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine

N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine (PubChem CID 83155520) has the molecular formula C10H8BrClN2S and a molecular weight of 303.61 g/mol. Its IUPAC name is N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine
PubChem CID83155520
Molecular FormulaC10H8BrClN2S
Molecular Weight303.61 g/mol
Exact Mass301.93
IUPAC NameN-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine
SMILESCc1ccc(Br)c(Nc2nc(Cl)cs2)c1
InChIInChI=1S/C10H8BrClN2S/c1-6-2-3-7(11)8(4-6)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14)
InChIKeyYASQZQMLNMPWDS-UHFFFAOYSA-N
XLogP4.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.61
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(2,4-dimethylphenyl)-1,3-thiazol-2-amine
CID 83153410
N-(5-bromo-4-fluoro-2-methylphenyl)-4-chloro-1,3-thiazol-2-amine
CID 107593321
5-bromo-N-(2-bromo-5-methylphenyl)-2-chloropyrimidin-4-amine
CID 82766176
N-(2-bromo-5-methylphenyl)-2-chloro-6-methylpyrimidin-4-amine
CID 82766798
4-(chloromethyl)-N-(2,5-dimethylphenyl)-1,3-thiazol-2-amine
CID 82179805
N-(3-bromo-4-methoxyphenyl)-4-chloro-1,3-thiazol-2-amine
CID 83156364
N-(2-bromo-5-methylphenyl)-6-chloro-2-cyclopropylpyrimidin-4-amine
CID 82767025
2-(2-bromo-5-chloroanilino)-1,3-thiazole-4-carboxylic acid
CID 81271892
4-chloro-N-(2,5-difluorophenyl)-1,3-thiazol-2-amine
CID 83152683
4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
CID 83152094
N-(2-bromo-5-methylphenyl)-3,5-dichloro-6-hydrazinylpyridin-2-amine
CID 102762492
4-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-1,3-thiazol-2-amine
CID 83152214

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine?
The IUPAC name of N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine (CID 83155520) is N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine is Cc1ccc(Br)c(Nc2nc(Cl)cs2)c1.
What is the InChIKey of N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine?
The InChIKey is YASQZQMLNMPWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrClN2S/c1-6-2-3-7(11)8(4-6)13-10-14-9(12)5-15-10/h2-5H,1H3,(H,13,14).
What are the key properties of N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine?
N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine has a molecular weight of 303.61 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-methylphenyl)-4-chloro-1,3-thiazol-2-amine is sourced from PubChem (CID 83155520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).