2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol

C10H7Cl2NOS — CID 107663379

IUPAC2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol
SMILESOc1cc(Cl)c(Cc2nccs2)cc1Cl
InChIInChI=1S/C10H7Cl2NOS/c11-7-5-9(14)8(12)3-6(7)4-10-13-1-2-15-10/h1-3,5,14H,4H2
InChIKeyFJPPTQVUCPWWLH-UHFFFAOYSA-N
MW260.14 g/mol
LogP3.75
Rot. Bonds2

About 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol

2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol (PubChem CID 107663379) has the molecular formula C10H7Cl2NOS and a molecular weight of 260.14 g/mol. Its IUPAC name is 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol.

Molecular Properties

Compound Name2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol
PubChem CID107663379
Molecular FormulaC10H7Cl2NOS
Molecular Weight260.14 g/mol
Exact Mass258.96
IUPAC Name2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol
SMILESOc1cc(Cl)c(Cc2nccs2)cc1Cl
InChIInChI=1S/C10H7Cl2NOS/c11-7-5-9(14)8(12)3-6(7)4-10-13-1-2-15-10/h1-3,5,14H,4H2
InChIKeyFJPPTQVUCPWWLH-UHFFFAOYSA-N
XLogP3.75
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.14
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol 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

1-[5-chloro-2-(1,3-thiazol-2-ylmethyl)phenyl]-N-methylmethanamine
CID 79824960
1-(2,4-dichlorophenyl)-3-(1,3-thiazol-2-yl)propan-2-ol
CID 79824781
5-chloro-3-(1,3-thiazol-2-ylmethyl)pyridin-2-amine
CID 79823747
2,5-dichloro-4-(chloromethyl)phenol
CID 130056378
1-(2,4-dichlorophenyl)-N-methyl-3-(1,3-thiazol-2-yl)propan-2-amine
CID 79824685
2-[(1,3-thiazol-2-ylmethylamino)methyl]phenol
CID 61284615
2-chloro-6-[[2-(1,3-thiazol-2-yl)ethylamino]methyl]phenol
CID 112554405
1-(2-bromo-5-chlorophenyl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 66159186
1-(4-chloro-2-fluorophenyl)-2-(1,3-thiazol-2-yl)ethanone
CID 112731600
N-[[2-chloro-5-(1,3-thiazol-2-ylmethyl)phenyl]methyl]propan-2-amine
CID 114076795
1-(4-amino-3,5-dichlorophenyl)-2-(1,3-thiazol-2-yl)ethanone
CID 116609810
1-(3,4-dichlorophenyl)-3-(1,3-thiazol-2-ylmethyl)urea
CID 110446996

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol?
The IUPAC name of 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol (CID 107663379) is 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol.
What is the SMILES notation for 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol?
The canonical SMILES for 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol is Oc1cc(Cl)c(Cc2nccs2)cc1Cl.
What is the InChIKey of 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol?
The InChIKey is FJPPTQVUCPWWLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2NOS/c11-7-5-9(14)8(12)3-6(7)4-10-13-1-2-15-10/h1-3,5,14H,4H2.
What are the key properties of 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol?
2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol has a molecular weight of 260.14 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-4-(1,3-thiazol-2-ylmethyl)phenol is sourced from PubChem (CID 107663379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).