bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone

C17H10N4OS2 — CID 175265157

IUPACbis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
SMILESO=C(c1csc(-c2cccnc2)n1)c1csc(-c2cccnc2)n1
InChIInChI=1S/C17H10N4OS2/c22-15(13-9-23-16(20-13)11-3-1-5-18-7-11)14-10-24-17(21-14)12-4-2-6-19-8-12/h1-10H
InChIKeyFXULXLWOLMCMLA-UHFFFAOYSA-N
MW350.43 g/mol
LogP3.95
Rot. Bonds4

About bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone

bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone (PubChem CID 175265157) has the molecular formula C17H10N4OS2 and a molecular weight of 350.43 g/mol. Its IUPAC name is bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone.

Molecular Properties

Compound Namebis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
PubChem CID175265157
Molecular FormulaC17H10N4OS2
Molecular Weight350.43 g/mol
Exact Mass350.03
IUPAC Namebis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
SMILESO=C(c1csc(-c2cccnc2)n1)c1csc(-c2cccnc2)n1
InChIInChI=1S/C17H10N4OS2/c22-15(13-9-23-16(20-13)11-3-1-5-18-7-11)14-10-24-17(21-14)12-4-2-6-19-8-12/h1-10H
InChIKeyFXULXLWOLMCMLA-UHFFFAOYSA-N
XLogP3.95
TPSA68.63 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone 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

1-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanone
CID 22888692
N-hydroxy-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 604917
3-oxo-3-(2-pyridin-3-yl-1,3-thiazol-4-yl)propanenitrile
CID 604918
morpholin-4-yl-(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone
CID 23467920
N-(2,3-dichlorophenyl)-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 110651203
N-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 155961799
S-(methylamino) N-amino-N-(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)carbamothioate
CID 21148157
N-benzyl-N-ethyl-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 110648241
(2-pyridin-3-yl-1,3-thiazol-4-yl)methanediol
CID 130242448
N-(2-formylthiophen-3-yl)-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 88563034
N-[(2-methylphenyl)methyl]-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 110647947
N-(5-chloro-2-methylphenyl)-2-pyridin-3-yl-1,3-thiazole-4-carboxamide
CID 110650067

Frequently Asked Questions

What is the IUPAC name of bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone?
The IUPAC name of bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone (CID 175265157) is bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone.
What is the SMILES notation for bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone?
The canonical SMILES for bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone is O=C(c1csc(-c2cccnc2)n1)c1csc(-c2cccnc2)n1.
What is the InChIKey of bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone?
The InChIKey is FXULXLWOLMCMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10N4OS2/c22-15(13-9-23-16(20-13)11-3-1-5-18-7-11)14-10-24-17(21-14)12-4-2-6-19-8-12/h1-10H.
What are the key properties of bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone?
bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone has a molecular weight of 350.43 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-pyridin-3-yl-1,3-thiazol-4-yl)methanone is sourced from PubChem (CID 175265157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).