4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine

C16H12N4S — CID 25167075

IUPAC4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1
InChIInChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19)
InChIKeyCTJAMSGCMYAVCZ-UHFFFAOYSA-N
MW292.37 g/mol
LogP4.43
Rot. Bonds3

About 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine

4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine (PubChem CID 25167075) has the molecular formula C16H12N4S and a molecular weight of 292.37 g/mol. Its IUPAC name is 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
PubChem CID25167075
Molecular FormulaC16H12N4S
Molecular Weight292.37 g/mol
Exact Mass292.08
IUPAC Name4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine
SMILESc1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1
InChIInChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19)
InChIKeyCTJAMSGCMYAVCZ-UHFFFAOYSA-N
XLogP4.43
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-(Quinolin-3-Yl)-2h-Indazol-5-Yl]-1,3-Thiazol-2-Amine
CID 87057584
4-(7-ethyl-1H-indol-3-yl)-N-prop-2-enyl-1,3-thiazol-2-amine
CID 8902468
(S)-N1-(5-(1H-indazol-6-yl)thiazol-2-yl)-3-(4-(trifluoromethyl)phenyl)propane-1,2-diamine
CID 23654255
N-benzyl-4-(1H-indazol-5-yl)-5-phenylthiazol-2-amine
CID 25164678
4-(1H-indazol-5-yl)-2-methylthiazole
CID 25167076
N-ethyl-4-(1H-indazol-5-yl)thiazol-2-amine
CID 25167077
N-benzyl-4-(1H-indazol-5-yl)thiazol-2-amine
CID 25167078
4-(1H-indazol-5-yl)thiazol-2-amine
CID 25167079
4-(1H-indazol-5-yl)-N-phenethylthiazol-2-amine
CID 25167275
N-(pyridin-2-yl)-5,6-dihydro-4H-thiazolo[4,5-e]indazol-2-amine
CID 46700737
N-(6-methylpyridin-2-yl)-5,6-dihydro-4H-thiazolo[4,5-e]indazol-2-amine
CID 46836497
N-pyrimidin-2-yl-5,6-dihydro-4H-pyrazolo[4,5-e][1,3]benzothiazol-2-amine
CID 46836714

Frequently Asked Questions

What is the IUPAC name of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine (CID 25167075) is 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine is c1ccc(Nc2nc(-c3ccc4[nH]ncc4c3)cs2)cc1.
What is the InChIKey of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
The InChIKey is CTJAMSGCMYAVCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4S/c1-2-4-13(5-3-1)18-16-19-15(10-21-16)11-6-7-14-12(8-11)9-17-20-14/h1-10H,(H,17,20)(H,18,19).
What are the key properties of 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine?
4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine has a molecular weight of 292.37 g/mol, XLogP of 4.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indazol-5-yl)-N-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 25167075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).