1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine

C18H16N4S — CID 123204084

IUPAC1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine
SMILESCn1c(-c2ccccc2)c(NNc2nccs2)c2ccccc21
InChIInChI=1S/C18H16N4S/c1-22-15-10-6-5-9-14(15)16(20-21-18-19-11-12-23-18)17(22)13-7-3-2-4-8-13/h2-12,20H,1H3,(H,19,21)
InChIKeyLEFKHWXWTVMFEX-UHFFFAOYSA-N
MW320.42 g/mol
LogP4.74
Rot. Bonds4

About 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine

1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine (PubChem CID 123204084) has the molecular formula C18H16N4S and a molecular weight of 320.42 g/mol. Its IUPAC name is 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine.

Molecular Properties

Compound Name1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine
PubChem CID123204084
Molecular FormulaC18H16N4S
Molecular Weight320.42 g/mol
Exact Mass320.11
IUPAC Name1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine
SMILESCn1c(-c2ccccc2)c(NNc2nccs2)c2ccccc21
InChIInChI=1S/C18H16N4S/c1-22-15-10-6-5-9-14(15)16(20-21-18-19-11-12-23-18)17(22)13-7-3-2-4-8-13/h2-12,20H,1H3,(H,19,21)
InChIKeyLEFKHWXWTVMFEX-UHFFFAOYSA-N
XLogP4.74
TPSA41.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine?
The IUPAC name of 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine (CID 123204084) is 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine.
What is the SMILES notation for 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine?
The canonical SMILES for 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine is Cn1c(-c2ccccc2)c(NNc2nccs2)c2ccccc21.
What is the InChIKey of 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine?
The InChIKey is LEFKHWXWTVMFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4S/c1-22-15-10-6-5-9-14(15)16(20-21-18-19-11-12-23-18)17(22)13-7-3-2-4-8-13/h2-12,20H,1H3,(H,19,21).
What are the key properties of 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine?
1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine has a molecular weight of 320.42 g/mol, XLogP of 4.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-2-phenylindol-3-yl)-2-(1,3-thiazol-2-yl)hydrazine is sourced from PubChem (CID 123204084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).