2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine

C15H9Cl2N3 — CID 135383450

IUPAC2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine
SMILESClc1cccc(-c2nc(Cl)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C15H9Cl2N3/c16-12-8-4-7-11(9-12)14-18-13(19-15(17)20-14)10-5-2-1-3-6-10/h1-9H
InChIKeyAOIZQBACFQBULG-UHFFFAOYSA-N
MW302.16 g/mol
LogP4.51
Rot. Bonds2

About 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine

2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine (PubChem CID 135383450) has the molecular formula C15H9Cl2N3 and a molecular weight of 302.16 g/mol. Its IUPAC name is 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine
PubChem CID135383450
Molecular FormulaC15H9Cl2N3
Molecular Weight302.16 g/mol
Exact Mass301.02
IUPAC Name2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine
SMILESClc1cccc(-c2nc(Cl)nc(-c3ccccc3)n2)c1
InChIInChI=1S/C15H9Cl2N3/c16-12-8-4-7-11(9-12)14-18-13(19-15(17)20-14)10-5-2-1-3-6-10/h1-9H
InChIKeyAOIZQBACFQBULG-UHFFFAOYSA-N
XLogP4.51
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.16
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine (CID 135383450) is 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine is Clc1cccc(-c2nc(Cl)nc(-c3ccccc3)n2)c1.
What is the InChIKey of 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine?
The InChIKey is AOIZQBACFQBULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2N3/c16-12-8-4-7-11(9-12)14-18-13(19-15(17)20-14)10-5-2-1-3-6-10/h1-9H.
What are the key properties of 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine?
2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine has a molecular weight of 302.16 g/mol, XLogP of 4.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(3-chlorophenyl)-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 135383450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).