(4-bromophenyl)-(1,2-thiazol-5-yl)methanol

C10H8BrNOS — CID 45158861

IUPAC(4-bromophenyl)-(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccc(Br)cc1)c1ccns1
InChIInChI=1S/C10H8BrNOS/c11-8-3-1-7(2-4-8)10(13)9-5-6-12-14-9/h1-6,10,13H
InChIKeyMENRJDFYANSUQH-UHFFFAOYSA-N
MW270.15 g/mol
LogP2.99
Rot. Bonds2

About (4-bromophenyl)-(1,2-thiazol-5-yl)methanol

(4-bromophenyl)-(1,2-thiazol-5-yl)methanol (PubChem CID 45158861) has the molecular formula C10H8BrNOS and a molecular weight of 270.15 g/mol. Its IUPAC name is (4-bromophenyl)-(1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(4-bromophenyl)-(1,2-thiazol-5-yl)methanol
PubChem CID45158861
Molecular FormulaC10H8BrNOS
Molecular Weight270.15 g/mol
Exact Mass268.95
IUPAC Name(4-bromophenyl)-(1,2-thiazol-5-yl)methanol
SMILESOC(c1ccc(Br)cc1)c1ccns1
InChIInChI=1S/C10H8BrNOS/c11-8-3-1-7(2-4-8)10(13)9-5-6-12-14-9/h1-6,10,13H
InChIKeyMENRJDFYANSUQH-UHFFFAOYSA-N
XLogP2.99
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.15
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-Fluoro-5-iodophenyl)-(1,2-thiazol-5-yl)methanol
CID 58221419
(2-Fluoro-5-methylphenyl)-(1,2-thiazol-5-yl)methanol
CID 143918348
(4-Methylphenyl)-(1,2-thiazol-5-yl)methanol
CID 119094111
(4-Propan-2-ylphenyl)-(1,2-thiazol-5-yl)methanol
CID 134975462
(4-Fluorophenyl)(1,2-thiazol-5-yl)methanol
CID 45158862
(S)-(4-fluorophenyl)-(1,2-thiazol-5-yl)methanol
CID 51900820
(R)-(4-fluorophenyl)-(1,2-thiazol-5-yl)methanol
CID 51900821
(3-Fluorophenyl)-(1,2-thiazol-5-yl)methanol
CID 130826091
6-bromo-1-(1,2-thiazol-5-yl)-3,4-dihydro-2H-naphthalen-1-ol
CID 18949041
Bis[4-(4-bromophenyl)-1,2-thiazol-5-yl]methanol
CID 18949045
3-Phenyl-1-(1,2-thiazol-5-yl)propan-1-ol
CID 71123420
3-(1,2-thiazol-5-yl)-1H-inden-1-ol
CID 90029763

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(1,2-thiazol-5-yl)methanol?
The IUPAC name of (4-bromophenyl)-(1,2-thiazol-5-yl)methanol (CID 45158861) is (4-bromophenyl)-(1,2-thiazol-5-yl)methanol.
What is the SMILES notation for (4-bromophenyl)-(1,2-thiazol-5-yl)methanol?
The canonical SMILES for (4-bromophenyl)-(1,2-thiazol-5-yl)methanol is OC(c1ccc(Br)cc1)c1ccns1.
What is the InChIKey of (4-bromophenyl)-(1,2-thiazol-5-yl)methanol?
The InChIKey is MENRJDFYANSUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrNOS/c11-8-3-1-7(2-4-8)10(13)9-5-6-12-14-9/h1-6,10,13H.
What are the key properties of (4-bromophenyl)-(1,2-thiazol-5-yl)methanol?
(4-bromophenyl)-(1,2-thiazol-5-yl)methanol has a molecular weight of 270.15 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 45158861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).