N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide

C19H15ClN4OS — CID 55959104

IUPACN-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide
SMILESCc1nc(NC(=O)c2cccc3cn[nH]c23)sc1Cc1ccccc1Cl
InChIInChI=1S/C19H15ClN4OS/c1-11-16(9-12-5-2-3-8-15(12)20)26-19(22-11)23-18(25)14-7-4-6-13-10-21-24-17(13)14/h2-8,10H,9H2,1H3,(H,21,24)(H,22,23,25)
InChIKeyITBLORWAGMDLKJ-UHFFFAOYSA-N
MW382.88 g/mol
LogP4.82
Rot. Bonds4

About N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide

N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide (PubChem CID 55959104) has the molecular formula C19H15ClN4OS and a molecular weight of 382.88 g/mol. Its IUPAC name is N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide
PubChem CID55959104
Molecular FormulaC19H15ClN4OS
Molecular Weight382.88 g/mol
Exact Mass382.07
IUPAC NameN-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide
SMILESCc1nc(NC(=O)c2cccc3cn[nH]c23)sc1Cc1ccccc1Cl
InChIInChI=1S/C19H15ClN4OS/c1-11-16(9-12-5-2-3-8-15(12)20)26-19(22-11)23-18(25)14-7-4-6-13-10-21-24-17(13)14/h2-8,10H,9H2,1H3,(H,21,24)(H,22,23,25)
InChIKeyITBLORWAGMDLKJ-UHFFFAOYSA-N
XLogP4.82
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.88
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[5-[(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-yl]benzamide
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N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 43836881
N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]piperidine-3-carboxamide
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N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]morpholine-2-carboxamide;hydrochloride
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CID 141338934
N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-2-(2-nitrophenyl)acetamide
CID 52699541
4-[[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]carbamoylamino]butanoic acid
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N-[2-[(dimethylamino)methyl]phenyl]-1H-indazole-7-carboxamide
CID 38436270
N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide
CID 43048604
N-[5-[(2-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 71938657
1-[[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]carbamoyl]piperidine-4-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide?
The IUPAC name of N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide (CID 55959104) is N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide.
What is the SMILES notation for N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide?
The canonical SMILES for N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide is Cc1nc(NC(=O)c2cccc3cn[nH]c23)sc1Cc1ccccc1Cl.
What is the InChIKey of N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide?
The InChIKey is ITBLORWAGMDLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN4OS/c1-11-16(9-12-5-2-3-8-15(12)20)26-19(22-11)23-18(25)14-7-4-6-13-10-21-24-17(13)14/h2-8,10H,9H2,1H3,(H,21,24)(H,22,23,25).
What are the key properties of N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide?
N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide has a molecular weight of 382.88 g/mol, XLogP of 4.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-chlorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]-1H-indazole-7-carboxamide is sourced from PubChem (CID 55959104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).