4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine

C10H8BrFN2OS — CID 79400376

IUPAC4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(Br)cs2)cc1F
InChIInChI=1S/C10H8BrFN2OS/c1-15-8-3-2-6(4-7(8)12)13-10-14-9(11)5-16-10/h2-5H,1H3,(H,13,14)
InChIKeyBWCINNZAVSEXMI-UHFFFAOYSA-N
MW303.16 g/mol
LogP3.80
Rot. Bonds3

About 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine

4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 79400376) has the molecular formula C10H8BrFN2OS and a molecular weight of 303.16 g/mol. Its IUPAC name is 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID79400376
Molecular FormulaC10H8BrFN2OS
Molecular Weight303.16 g/mol
Exact Mass301.95
IUPAC Name4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccc(Nc2nc(Br)cs2)cc1F
InChIInChI=1S/C10H8BrFN2OS/c1-15-8-3-2-6(4-7(8)12)13-10-14-9(11)5-16-10/h2-5H,1H3,(H,13,14)
InChIKeyBWCINNZAVSEXMI-UHFFFAOYSA-N
XLogP3.80
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-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

4-bromo-N-(3,4-dimethoxyphenyl)-1,3-thiazol-2-amine
CID 79400359
4-bromo-N-(4-fluoro-3-methylphenyl)-1,3-thiazol-2-amine
CID 79398809
N-(3-fluoro-4-methoxyphenyl)-4-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine;hydrochloride
CID 72720229
N-(3-bromo-4-methoxyphenyl)-4-chloro-1,3-thiazol-2-amine
CID 83156364
4-bromo-N-(6-bromonaphthalen-2-yl)-1,3-thiazol-2-amine
CID 81259901
4-bromo-N-(3-methylsulfanylphenyl)-1,3-thiazol-2-amine
CID 79399128
N-(3-fluoro-4-methoxyphenyl)-6-methoxy-1,3-benzothiazol-2-amine
CID 53414489
2-(3-fluoro-4-methoxyanilino)-1,3-benzothiazol-6-ol
CID 142733980
4-(4-bromophenyl)-N-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-amine
CID 142697325
3,5-dibromo-N-(3-fluoro-4-methoxyphenyl)pyridin-2-amine
CID 113413794
3-fluoro-4-methoxy-N-methylaniline
CID 21307269
3-N-(4-bromo-1,3-thiazol-2-yl)benzene-1,3-diamine
CID 79398738

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine (CID 79400376) is 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccc(Nc2nc(Br)cs2)cc1F.
What is the InChIKey of 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is BWCINNZAVSEXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN2OS/c1-15-8-3-2-6(4-7(8)12)13-10-14-9(11)5-16-10/h2-5H,1H3,(H,13,14).
What are the key properties of 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine?
4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 303.16 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 79400376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).