1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol

C20H17N5OS — CID 155167548

IUPAC1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol
SMILESCc1ccc2nc(C(C)(O)c3cnc(-c4cccc5[nH]ncc45)s3)cn2c1
InChIInChI=1S/C20H17N5OS/c1-12-6-7-18-23-16(11-25(18)10-12)20(2,26)17-9-21-19(27-17)13-4-3-5-15-14(13)8-22-24-15/h3-11,26H,1-2H3,(H,22,24)
InChIKeyDGTCSKRKIPGVEE-UHFFFAOYSA-N
MW375.46 g/mol
LogP3.90
Rot. Bonds3

About 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol

1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol (PubChem CID 155167548) has the molecular formula C20H17N5OS and a molecular weight of 375.46 g/mol. Its IUPAC name is 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol.

Molecular Properties

Compound Name1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol
PubChem CID155167548
Molecular FormulaC20H17N5OS
Molecular Weight375.46 g/mol
Exact Mass375.12
IUPAC Name1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol
SMILESCc1ccc2nc(C(C)(O)c3cnc(-c4cccc5[nH]ncc45)s3)cn2c1
InChIInChI=1S/C20H17N5OS/c1-12-6-7-18-23-16(11-25(18)10-12)20(2,26)17-9-21-19(27-17)13-4-3-5-15-14(13)8-22-24-15/h3-11,26H,1-2H3,(H,22,24)
InChIKeyDGTCSKRKIPGVEE-UHFFFAOYSA-N
XLogP3.90
TPSA79.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.46
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol?
The IUPAC name of 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol (CID 155167548) is 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol.
What is the SMILES notation for 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol?
The canonical SMILES for 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol is Cc1ccc2nc(C(C)(O)c3cnc(-c4cccc5[nH]ncc45)s3)cn2c1.
What is the InChIKey of 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol?
The InChIKey is DGTCSKRKIPGVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5OS/c1-12-6-7-18-23-16(11-25(18)10-12)20(2,26)17-9-21-19(27-17)13-4-3-5-15-14(13)8-22-24-15/h3-11,26H,1-2H3,(H,22,24).
What are the key properties of 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol?
1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol has a molecular weight of 375.46 g/mol, XLogP of 3.90, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1H-indazol-4-yl)-1,3-thiazol-5-yl]-1-(6-methylimidazo[1,2-a]pyridin-2-yl)ethanol is sourced from PubChem (CID 155167548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).