10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine

C8H6N4S — CID 137166398

IUPAC10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine
SMILESc1ccc2c(c1)Nc1ncnn1S2
InChIInChI=1S/C8H6N4S/c1-2-4-7-6(3-1)11-8-9-5-10-12(8)13-7/h1-5H,(H,9,10,11)
InChIKeyHFQKIEPYNPHJPT-UHFFFAOYSA-N
MW190.23 g/mol
LogP1.89
Rot. Bonds

About 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine

10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine (PubChem CID 137166398) has the molecular formula C8H6N4S and a molecular weight of 190.23 g/mol. Its IUPAC name is 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine.

Molecular Properties

Compound Name10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine
PubChem CID137166398
Molecular FormulaC8H6N4S
Molecular Weight190.23 g/mol
Exact Mass190.03
IUPAC Name10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine
SMILESc1ccc2c(c1)Nc1ncnn1S2
InChIInChI=1S/C8H6N4S/c1-2-4-7-6(3-1)11-8-9-5-10-12(8)13-7/h1-5H,(H,9,10,11)
InChIKeyHFQKIEPYNPHJPT-UHFFFAOYSA-N
XLogP1.89
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.23
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methylamino)-4H-1,2,4-benzothiadiazin-3-one
CID 70417080
2-methyl-4H-1,4-benzothiazine-3-thione
CID 84614586
2-hydroxy-3H-1,2,3-benzothiadiazole
CID 66810769
copper;10H-phenothiazine;hydrochloride
CID 70634229
ethane;10H-phenothiazine
CID 90730014
3H-1,2,3-benzothiadiazol-2-ylboronic acid
CID 141298211
boric acid;10H-phenothiazine
CID 159987394
(2S)-2-[1-methyl-5-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]pyrrol-2-yl]-4H-1,4-benzothiazin-3-one
CID 2470520
1-methyl-10H-pyrazolo[3,4-b]phenothiazine
CID 135506169
N-(10H-phenothiazin-1-yl)-10H-phenothiazin-1-amine
CID 156694386
3-amino-5H-1,5-benzothiazepin-4-one
CID 70506908
N,N-dimethyl-6-spiro[4H-1,2,4-benzothiadiazine-3,3'-dioxirane]-2-ylpyridin-2-amine
CID 118046282

Frequently Asked Questions

What is the IUPAC name of 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine?
The IUPAC name of 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine (CID 137166398) is 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine.
What is the SMILES notation for 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine?
The canonical SMILES for 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine is c1ccc2c(c1)Nc1ncnn1S2.
What is the InChIKey of 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine?
The InChIKey is HFQKIEPYNPHJPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4S/c1-2-4-7-6(3-1)11-8-9-5-10-12(8)13-7/h1-5H,(H,9,10,11).
What are the key properties of 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine?
10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine has a molecular weight of 190.23 g/mol, XLogP of 1.89, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-[1,2,4]triazolo[1,5-b][1,2,4]benzothiadiazine is sourced from PubChem (CID 137166398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).