2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine

C5H3Cl2N3S — CID 22338691

IUPAC2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine
SMILESC=CSc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C5H3Cl2N3S/c1-2-11-5-9-3(6)8-4(7)10-5/h2H,1H2
InChIKeyMNVZHVDNFFGEDM-UHFFFAOYSA-N
MW208.07 g/mol
LogP2.41
Rot. Bonds2

About 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine

2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine (PubChem CID 22338691) has the molecular formula C5H3Cl2N3S and a molecular weight of 208.07 g/mol. Its IUPAC name is 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine
PubChem CID22338691
Molecular FormulaC5H3Cl2N3S
Molecular Weight208.07 g/mol
Exact Mass206.94
IUPAC Name2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine
SMILESC=CSc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C5H3Cl2N3S/c1-2-11-5-9-3(6)8-4(7)10-5/h2H,1H2
InChIKeyMNVZHVDNFFGEDM-UHFFFAOYSA-N
XLogP2.41
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.07
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine (CID 22338691) is 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine is C=CSc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine?
The InChIKey is MNVZHVDNFFGEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2N3S/c1-2-11-5-9-3(6)8-4(7)10-5/h2H,1H2.
What are the key properties of 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine?
2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine has a molecular weight of 208.07 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-ethenylsulfanyl-1,3,5-triazine is sourced from PubChem (CID 22338691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).