5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole

C17H9ClN6OS — CID 167849504

IUPAC5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole
SMILESClc1cccnc1-c1nc(-c2nc(-c3n[nH]c4ccccc34)no2)cs1
InChIInChI=1S/C17H9ClN6OS/c18-10-5-3-7-19-14(10)17-20-12(8-26-17)16-21-15(24-25-16)13-9-4-1-2-6-11(9)22-23-13/h1-8H,(H,22,23)
InChIKeySUQVRYWFBBFYIG-UHFFFAOYSA-N
MW380.82 g/mol
LogP4.45
Rot. Bonds3

About 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole

5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole (PubChem CID 167849504) has the molecular formula C17H9ClN6OS and a molecular weight of 380.82 g/mol. Its IUPAC name is 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole
PubChem CID167849504
Molecular FormulaC17H9ClN6OS
Molecular Weight380.82 g/mol
Exact Mass380.02
IUPAC Name5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole
SMILESClc1cccnc1-c1nc(-c2nc(-c3n[nH]c4ccccc34)no2)cs1
InChIInChI=1S/C17H9ClN6OS/c18-10-5-3-7-19-14(10)17-20-12(8-26-17)16-21-15(24-25-16)13-9-4-1-2-6-11(9)22-23-13/h1-8H,(H,22,23)
InChIKeySUQVRYWFBBFYIG-UHFFFAOYSA-N
XLogP4.45
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.82
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole with MolForge

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Related Compounds

4-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-amine
CID 103442626
3-(1H-indazol-3-yl)-5-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-1,2,4-oxadiazole
CID 167819354
2-[2-(1H-indazol-3-yl)-1,3-thiazol-4-yl]phenol
CID 22259251
5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]furan-3-carboxylic acid
CID 103442924
2-(1H-indazol-3-yl)-4-(4-methylphenyl)-1,3-thiazole
CID 22259263
5-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-1H-1,2,4-triazol-3-amine
CID 103442682
2-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-3-fluoroaniline
CID 103442788
3-(3-fluorophenyl)-5-(1H-indazol-3-yl)-1,2,4-oxadiazole
CID 56770576
4-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N,3-dimethyl-1,2-thiazol-5-amine
CID 103442639
1-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]ethanamine
CID 103445012
5-chloro-2-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136847807
4-chloro-3-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]aniline
CID 103442570

Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole?
The IUPAC name of 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole (CID 167849504) is 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole?
The canonical SMILES for 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole is Clc1cccnc1-c1nc(-c2nc(-c3n[nH]c4ccccc34)no2)cs1.
What is the InChIKey of 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole?
The InChIKey is SUQVRYWFBBFYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9ClN6OS/c18-10-5-3-7-19-14(10)17-20-12(8-26-17)16-21-15(24-25-16)13-9-4-1-2-6-11(9)22-23-13/h1-8H,(H,22,23).
What are the key properties of 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole?
5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole has a molecular weight of 380.82 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-chloro-2-pyridinyl)-1,3-thiazol-4-yl]-3-(1H-indazol-3-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 167849504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).