2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole

C14H11N3S — CID 91499200

IUPAC2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole
SMILESc1ccc2c(c1)NC(c1ccn3ccnc3c1)S2
InChIInChI=1S/C14H11N3S/c1-2-4-12-11(3-1)16-14(18-12)10-5-7-17-8-6-15-13(17)9-10/h1-9,14,16H
InChIKeyDULQPQGCLZLMIU-UHFFFAOYSA-N
MW253.33 g/mol
LogP3.55
Rot. Bonds1

About 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole

2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole (PubChem CID 91499200) has the molecular formula C14H11N3S and a molecular weight of 253.33 g/mol. Its IUPAC name is 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole.

Molecular Properties

Compound Name2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole
PubChem CID91499200
Molecular FormulaC14H11N3S
Molecular Weight253.33 g/mol
Exact Mass253.07
IUPAC Name2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole
SMILESc1ccc2c(c1)NC(c1ccn3ccnc3c1)S2
InChIInChI=1S/C14H11N3S/c1-2-4-12-11(3-1)16-14(18-12)10-5-7-17-8-6-15-13(17)9-10/h1-9,14,16H
InChIKeyDULQPQGCLZLMIU-UHFFFAOYSA-N
XLogP3.55
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole?
The IUPAC name of 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole (CID 91499200) is 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole.
What is the SMILES notation for 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole?
The canonical SMILES for 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole is c1ccc2c(c1)NC(c1ccn3ccnc3c1)S2.
What is the InChIKey of 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole?
The InChIKey is DULQPQGCLZLMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3S/c1-2-4-12-11(3-1)16-14(18-12)10-5-7-17-8-6-15-13(17)9-10/h1-9,14,16H.
What are the key properties of 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole?
2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole has a molecular weight of 253.33 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[1,2-a]pyridin-7-yl-2,3-dihydro-1,3-benzothiazole is sourced from PubChem (CID 91499200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).