2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole

C19H20N4OS2 — CID 168979229

IUPAC2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole
SMILESCOc1c2cc(-c3nc4sc(C5CCNCC5)cc4s3)ccc2nn1C
InChIInChI=1S/C19H20N4OS2/c1-23-19(24-2)13-9-12(3-4-14(13)22-23)17-21-18-16(26-17)10-15(25-18)11-5-7-20-8-6-11/h3-4,9-11,20H,5-8H2,1-2H3
InChIKeyQUHPYMSUMCZGDV-UHFFFAOYSA-N
MW384.53 g/mol
LogP4.39
Rot. Bonds3

About 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole

2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole (PubChem CID 168979229) has the molecular formula C19H20N4OS2 and a molecular weight of 384.53 g/mol. Its IUPAC name is 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole.

Molecular Properties

Compound Name2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole
PubChem CID168979229
Molecular FormulaC19H20N4OS2
Molecular Weight384.53 g/mol
Exact Mass384.11
IUPAC Name2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole
SMILESCOc1c2cc(-c3nc4sc(C5CCNCC5)cc4s3)ccc2nn1C
InChIInChI=1S/C19H20N4OS2/c1-23-19(24-2)13-9-12(3-4-14(13)22-23)17-21-18-16(26-17)10-15(25-18)11-5-7-20-8-6-11/h3-4,9-11,20H,5-8H2,1-2H3
InChIKeyQUHPYMSUMCZGDV-UHFFFAOYSA-N
XLogP4.39
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.53
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-fluoro-2-methyl-6-(5-piperidin-4-ylthieno[2,3-d][1,3]thiazol-2-yl)-1,3-benzothiazole;hydrochloride
CID 162433200
2-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole
CID 168979307
2-(4-methoxyphenyl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)-1,3-thiazole-5-carboxamide
CID 120642480
2-(4-methoxyphenyl)-4-piperidin-4-ylpyridine
CID 95846619
2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 156888103
2-(2-methylindazol-5-yl)-6-piperidin-4-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
CID 156888108
2-(4-methylphenyl)-6-pyrrolidin-3-yloxy-1,3-benzothiazole
CID 82190025
4-[1,5-bis(4-methoxyphenyl)-4-methylpyrazol-3-yl]piperidine
CID 145464422
ethyl 2-[7-(4-chlorophenyl)-5-methyl-2-(1-methyl-3-piperidin-4-ylindazol-5-yl)-1,3-benzothiazol-6-yl]acetate;2-methylpropan-2-ol
CID 142316676
6-(7-ethyl-2-methylindazol-5-yl)-2-piperidin-4-yl-1,3-benzothiazole
CID 151072490
5-(2-methylindazol-5-yl)-2-piperidin-4-yl-6H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 156888736
6-(2,7-dimethylindazol-5-yl)-2-piperidin-4-yl-1,3-benzothiazole;hydrochloride
CID 153383029

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole?
The IUPAC name of 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole (CID 168979229) is 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole.
What is the SMILES notation for 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole?
The canonical SMILES for 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole is COc1c2cc(-c3nc4sc(C5CCNCC5)cc4s3)ccc2nn1C.
What is the InChIKey of 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole?
The InChIKey is QUHPYMSUMCZGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4OS2/c1-23-19(24-2)13-9-12(3-4-14(13)22-23)17-21-18-16(26-17)10-15(25-18)11-5-7-20-8-6-11/h3-4,9-11,20H,5-8H2,1-2H3.
What are the key properties of 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole?
2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole has a molecular weight of 384.53 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-2-methylindazol-5-yl)-5-piperidin-4-ylthieno[2,3-d][1,3]thiazole is sourced from PubChem (CID 168979229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).