2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole

C15H9ClN2S — CID 12926115

IUPAC2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESClc1ccccc1-c1cn2c(n1)sc1ccccc12
InChIInChI=1S/C15H9ClN2S/c16-11-6-2-1-5-10(11)12-9-18-13-7-3-4-8-14(13)19-15(18)17-12/h1-9H
InChIKeyMJVJBAMSJWVOHE-UHFFFAOYSA-N
MW284.77 g/mol
LogP4.87
Rot. Bonds1

About 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole

2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole (PubChem CID 12926115) has the molecular formula C15H9ClN2S and a molecular weight of 284.77 g/mol. Its IUPAC name is 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole
PubChem CID12926115
Molecular FormulaC15H9ClN2S
Molecular Weight284.77 g/mol
Exact Mass284.02
IUPAC Name2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole
SMILESClc1ccccc1-c1cn2c(n1)sc1ccccc12
InChIInChI=1S/C15H9ClN2S/c16-11-6-2-1-5-10(11)12-9-18-13-7-3-4-8-14(13)19-15(18)17-12/h1-9H
InChIKeyMJVJBAMSJWVOHE-UHFFFAOYSA-N
XLogP4.87
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.77
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole (CID 12926115) is 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole is Clc1ccccc1-c1cn2c(n1)sc1ccccc12.
What is the InChIKey of 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole?
The InChIKey is MJVJBAMSJWVOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClN2S/c16-11-6-2-1-5-10(11)12-9-18-13-7-3-4-8-14(13)19-15(18)17-12/h1-9H.
What are the key properties of 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole?
2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole has a molecular weight of 284.77 g/mol, XLogP of 4.87, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)imidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 12926115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).