N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide

C18H14N4OS — CID 40672202

IUPACN-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide
SMILESCc1ccc(-c2csc(NC(=O)c3n[nH]c4ccccc34)n2)cc1
InChIInChI=1S/C18H14N4OS/c1-11-6-8-12(9-7-11)15-10-24-18(19-15)20-17(23)16-13-4-2-3-5-14(13)21-22-16/h2-10H,1H3,(H,21,22)(H,19,20,23)
InChIKeyOLZMAVFWLWCGQW-UHFFFAOYSA-N
MW334.40 g/mol
LogP4.25
Rot. Bonds3

About N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide

N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide (PubChem CID 40672202) has the molecular formula C18H14N4OS and a molecular weight of 334.40 g/mol. Its IUPAC name is N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide
PubChem CID40672202
Molecular FormulaC18H14N4OS
Molecular Weight334.40 g/mol
Exact Mass334.09
IUPAC NameN-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide
SMILESCc1ccc(-c2csc(NC(=O)c3n[nH]c4ccccc34)n2)cc1
InChIInChI=1S/C18H14N4OS/c1-11-6-8-12(9-7-11)15-10-24-18(19-15)20-17(23)16-13-4-2-3-5-14(13)21-22-16/h2-10H,1H3,(H,21,22)(H,19,20,23)
InChIKeyOLZMAVFWLWCGQW-UHFFFAOYSA-N
XLogP4.25
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56564978
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 16619036
[2-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 1H-indazole-3-carboxylate
CID 7956410
ethane;N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 153338927
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-phenyl-1H-pyrrole-3-carboxamide
CID 56930773
N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 154796255
N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-1H-indazole-3-carboxamide
CID 41452060
5-methyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole-3-carboxamide
CID 16953644
N-(2,4-dimethyl-1,3-thiazol-5-yl)-1H-indazole-3-carboxamide
CID 166229758
2-(1H-indazol-3-yl)-4-(4-methylphenyl)-1,3-thiazole
CID 22259263
3-(1H-indazole-3-carbonylamino)-4-methylthiophene-2-carboxylic acid
CID 114914987
N-[4-(2-methylphenyl)-1,3-thiazol-2-yl]-5-nitro-1H-indazole-3-carboxamide
CID 112821488

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide (CID 40672202) is N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide is Cc1ccc(-c2csc(NC(=O)c3n[nH]c4ccccc34)n2)cc1.
What is the InChIKey of N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide?
The InChIKey is OLZMAVFWLWCGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4OS/c1-11-6-8-12(9-7-11)15-10-24-18(19-15)20-17(23)16-13-4-2-3-5-14(13)21-22-16/h2-10H,1H3,(H,21,22)(H,19,20,23).
What are the key properties of N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide?
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide has a molecular weight of 334.40 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 40672202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).