3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine

C9H8Cl2N4S2 — CID 102761582

IUPAC3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine
SMILESCCc1nsc(Sc2nc(N)c(Cl)cc2Cl)n1
InChIInChI=1S/C9H8Cl2N4S2/c1-2-6-13-9(17-15-6)16-8-5(11)3-4(10)7(12)14-8/h3H,2H2,1H3,(H2,12,14)
InChIKeyBGLFFXKPPFYPOB-UHFFFAOYSA-N
MW307.23 g/mol
LogP3.54
Rot. Bonds3

About 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine

3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine (PubChem CID 102761582) has the molecular formula C9H8Cl2N4S2 and a molecular weight of 307.23 g/mol. Its IUPAC name is 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine
PubChem CID102761582
Molecular FormulaC9H8Cl2N4S2
Molecular Weight307.23 g/mol
Exact Mass305.96
IUPAC Name3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine
SMILESCCc1nsc(Sc2nc(N)c(Cl)cc2Cl)n1
InChIInChI=1S/C9H8Cl2N4S2/c1-2-6-13-9(17-15-6)16-8-5(11)3-4(10)7(12)14-8/h3H,2H2,1H3,(H2,12,14)
InChIKeyBGLFFXKPPFYPOB-UHFFFAOYSA-N
XLogP3.54
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.23
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,5-dichloro-6-(1,3,4-thiadiazol-2-ylsulfanyl)pyridin-2-amine
CID 102761263
3-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]-5-methylaniline
CID 112648832
3,5-dichloro-6-methylsulfanylpyridin-2-amine
CID 102761414
[2-chloro-4-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]phenyl]methanol
CID 114065037
[6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]-5-methyl-3-pyridinyl]methanamine
CID 80650767
2-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]-4,5-dimethoxyaniline
CID 83008111
6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyrazin-2-amine
CID 80647034
5-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyrazin-2-amine
CID 80663619
2-tert-butyl-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyrimidin-4-amine
CID 80963962
8-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]imidazo[1,2-a]pyrazin-6-amine
CID 80894487
6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]-4-(trifluoromethyl)pyridin-2-amine
CID 102720407
4-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-3-amine
CID 65275072

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine (CID 102761582) is 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine is CCc1nsc(Sc2nc(N)c(Cl)cc2Cl)n1.
What is the InChIKey of 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine?
The InChIKey is BGLFFXKPPFYPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Cl2N4S2/c1-2-6-13-9(17-15-6)16-8-5(11)3-4(10)7(12)14-8/h3H,2H2,1H3,(H2,12,14).
What are the key properties of 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine?
3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine has a molecular weight of 307.23 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]pyridin-2-amine is sourced from PubChem (CID 102761582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).