5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole

C15H13N5S — CID 56745547

IUPAC5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(-c2nccn2-c2ccc3cn[nH]c3c2)s1
InChIInChI=1S/C15H13N5S/c1-9-14(21-10(2)18-9)15-16-5-6-20(15)12-4-3-11-8-17-19-13(11)7-12/h3-8H,1-2H3,(H,17,19)
InChIKeyHSTNLVVNBYLVIF-UHFFFAOYSA-N
MW295.37 g/mol
LogP3.49
Rot. Bonds2

About 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole

5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole (PubChem CID 56745547) has the molecular formula C15H13N5S and a molecular weight of 295.37 g/mol. Its IUPAC name is 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole
PubChem CID56745547
Molecular FormulaC15H13N5S
Molecular Weight295.37 g/mol
Exact Mass295.09
IUPAC Name5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole
SMILESCc1nc(C)c(-c2nccn2-c2ccc3cn[nH]c3c2)s1
InChIInChI=1S/C15H13N5S/c1-9-14(21-10(2)18-9)15-16-5-6-20(15)12-4-3-11-8-17-19-13(11)7-12/h3-8H,1-2H3,(H,17,19)
InChIKeyHSTNLVVNBYLVIF-UHFFFAOYSA-N
XLogP3.49
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-aminoethyl)-12-methyl-4-(1H-pyrazol-4-yl)-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093431
US8754233, (4-Benzothiazol-2-yl-1H-pyrazol-3-yl)-[2-(1H-imidazol-4-yl)-ethyl]-amine
CID 66768033
N-cyclohexyl-6-(1H-indazol-5-yl)imidazo[2,1-b]thiazol-5-amine
CID 25166869
5-(2-aminoethyl)-7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46224684
5-(3-aminopropyl)-7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46224697
5-(4-aminobutyl)-7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46224701
7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5-isopropyl-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46226038
4-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-N-(2-methyl-4,5,6,7-tetrahydroindazol-3-yl)-1,3-thiazol-2-amine
CID 89657803
N-(2-ethyl-4,5,6,7-tetrahydroindazol-3-yl)-4-[4-(4-methylimidazol-1-yl)phenyl]-1,3-thiazol-2-amine
CID 89657806
N-(3-tert-butyl-1-ethylpyrazol-5-yl)-4-[4-(4-methylimidazol-1-yl)phenyl]-1,3-thiazol-2-amine
CID 89657807
N-(3-tert-butyl-1-methylpyrazol-5-yl)-4-[4-(4-methylimidazol-1-yl)phenyl]-1,3-thiazol-2-amine
CID 89657808
gamma-Secretase modulator 13
CID 89657810

Frequently Asked Questions

What is the IUPAC name of 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole (CID 56745547) is 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole is Cc1nc(C)c(-c2nccn2-c2ccc3cn[nH]c3c2)s1.
What is the InChIKey of 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole?
The InChIKey is HSTNLVVNBYLVIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5S/c1-9-14(21-10(2)18-9)15-16-5-6-20(15)12-4-3-11-8-17-19-13(11)7-12/h3-8H,1-2H3,(H,17,19).
What are the key properties of 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole?
5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole has a molecular weight of 295.37 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(1H-indazol-6-yl)imidazol-2-yl]-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 56745547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).