(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol

C15H10Cl2N2OS — CID 56658919

IUPAC(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol
SMILESOC(c1ccc(Cl)cc1)(c1cccnc1)c1cnc(Cl)s1
InChIInChI=1S/C15H10Cl2N2OS/c16-12-5-3-10(4-6-12)15(20,11-2-1-7-18-8-11)13-9-19-14(17)21-13/h1-9,20H
InChIKeyLMEDUIHCIDNPGF-UHFFFAOYSA-N
MW337.23 g/mol
LogP4.13
Rot. Bonds3

About (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol

(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol (PubChem CID 56658919) has the molecular formula C15H10Cl2N2OS and a molecular weight of 337.23 g/mol. Its IUPAC name is (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol
PubChem CID56658919
Molecular FormulaC15H10Cl2N2OS
Molecular Weight337.23 g/mol
Exact Mass335.99
IUPAC Name(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol
SMILESOC(c1ccc(Cl)cc1)(c1cccnc1)c1cnc(Cl)s1
InChIInChI=1S/C15H10Cl2N2OS/c16-12-5-3-10(4-6-12)15(20,11-2-1-7-18-8-11)13-9-19-14(17)21-13/h1-9,20H
InChIKeyLMEDUIHCIDNPGF-UHFFFAOYSA-N
XLogP4.13
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.23
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol?
The IUPAC name of (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol (CID 56658919) is (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol is OC(c1ccc(Cl)cc1)(c1cccnc1)c1cnc(Cl)s1.
What is the InChIKey of (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol?
The InChIKey is LMEDUIHCIDNPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2OS/c16-12-5-3-10(4-6-12)15(20,11-2-1-7-18-8-11)13-9-19-14(17)21-13/h1-9,20H.
What are the key properties of (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol?
(4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol has a molecular weight of 337.23 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(2-chloro-1,3-thiazol-5-yl)-pyridin-3-ylmethanol is sourced from PubChem (CID 56658919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).