2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole

C17H11ClN4OS — CID 127050735

IUPAC2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
SMILESCc1nc(-c2cccnc2)sc1-c1nnc(-c2ccccc2Cl)o1
InChIInChI=1S/C17H11ClN4OS/c1-10-14(24-17(20-10)11-5-4-8-19-9-11)16-22-21-15(23-16)12-6-2-3-7-13(12)18/h2-9H,1H3
InChIKeyVRABMSMVKIVJMR-UHFFFAOYSA-N
MW354.82 g/mol
LogP4.88
Rot. Bonds3

About 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole

2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole (PubChem CID 127050735) has the molecular formula C17H11ClN4OS and a molecular weight of 354.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
PubChem CID127050735
Molecular FormulaC17H11ClN4OS
Molecular Weight354.82 g/mol
Exact Mass354.03
IUPAC Name2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
SMILESCc1nc(-c2cccnc2)sc1-c1nnc(-c2ccccc2Cl)o1
InChIInChI=1S/C17H11ClN4OS/c1-10-14(24-17(20-10)11-5-4-8-19-9-11)16-22-21-15(23-16)12-6-2-3-7-13(12)18/h2-9H,1H3
InChIKeyVRABMSMVKIVJMR-UHFFFAOYSA-N
XLogP4.88
TPSA64.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ethyl 4-(2-chlorophenyl)-2-pyridin-4-yl-1,3-thiazole-5-carboxylate
CID 90643515
2-(4-Phenyl-2-pyridin-4-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 90643530
2-[(6-Chloro-3-pyridinyl)methyl]-4-[(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)methyl]phthalazin-1-one
CID 49845523
4-[[5-(6-Chloro-3-pyridinyl)-1,3,4-oxadiazol-2-yl]methyl]-2-[(2-chloro-1,3-thiazol-5-yl)methyl]phthalazin-1-one
CID 49845684
2-[1-[(2-Chlorophenyl)methyl]piperidin-4-yl]-5-(4-methyl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 92598898
2-(4-Methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-5-phenyl-1,3,4-oxadiazole
CID 127049247
2-(4-Chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 127049555
2-(3-Methylphenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 127049918
2-(4-Methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-5-pyridin-3-yl-1,3,4-oxadiazole
CID 127050732
2-(4-Methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-5-pyridin-4-yl-1,3,4-oxadiazole
CID 127050733
2-(4-Bromophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 127050734
2-(2,3-Dichlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 127050736

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole (CID 127050735) is 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole is Cc1nc(-c2cccnc2)sc1-c1nnc(-c2ccccc2Cl)o1.
What is the InChIKey of 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole?
The InChIKey is VRABMSMVKIVJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN4OS/c1-10-14(24-17(20-10)11-5-4-8-19-9-11)16-22-21-15(23-16)12-6-2-3-7-13(12)18/h2-9H,1H3.
What are the key properties of 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole?
2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole has a molecular weight of 354.82 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-5-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 127050735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).