2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine

C10H6BrCl2N3O — CID 82823763

IUPAC2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine
SMILESClc1nc(Cl)nc(OCc2ccccc2Br)n1
InChIInChI=1S/C10H6BrCl2N3O/c11-7-4-2-1-3-6(7)5-17-10-15-8(12)14-9(13)16-10/h1-4H,5H2
InChIKeyIMQXCWNIKIYHTF-UHFFFAOYSA-N
MW334.99 g/mol
LogP3.52
Rot. Bonds3

About 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine

2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine (PubChem CID 82823763) has the molecular formula C10H6BrCl2N3O and a molecular weight of 334.99 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine.

Molecular Properties

Compound Name2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine
PubChem CID82823763
Molecular FormulaC10H6BrCl2N3O
Molecular Weight334.99 g/mol
Exact Mass332.91
IUPAC Name2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine
SMILESClc1nc(Cl)nc(OCc2ccccc2Br)n1
InChIInChI=1S/C10H6BrCl2N3O/c11-7-4-2-1-3-6(7)5-17-10-15-8(12)14-9(13)16-10/h1-4H,5H2
InChIKeyIMQXCWNIKIYHTF-UHFFFAOYSA-N
XLogP3.52
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.99
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-bromophenyl)methoxy]-2-chloro-6-(trifluoromethyl)pyrimidine
CID 114562131
[2-[(2-bromophenyl)methoxy]-4-methylpyrimidin-5-yl]methanamine
CID 83195620
4-[(2-bromophenyl)methoxy]-5-chloropyrimidin-2-amine
CID 82824989
[6-[(2-bromophenyl)methoxy]-2-pyridinyl]methanamine
CID 82828361
4-[(2-bromophenyl)methoxy]-2-chloroquinoline
CID 42597758
2-[(2-bromophenyl)methoxy]pyridine
CID 24799165
4-[(2-bromophenyl)methoxy]-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 82825396
4-[(2-bromophenyl)methoxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 82808235
4-chloro-6-[(2-chlorophenyl)methoxy]-N,N-diethyl-1,3,5-triazin-2-amine
CID 62870466
[2-[(2-bromophenyl)methoxy]-3-pyridinyl]methanamine
CID 82828202
4-[(2-bromophenyl)methoxy]-6-chloro-2-methylsulfanylpyrimidine
CID 82824209
1-[(2-bromophenyl)methoxy]-4-chloro-2-fluorobenzene
CID 146004192

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine?
The IUPAC name of 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine (CID 82823763) is 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine.
What is the SMILES notation for 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine?
The canonical SMILES for 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine is Clc1nc(Cl)nc(OCc2ccccc2Br)n1.
What is the InChIKey of 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine?
The InChIKey is IMQXCWNIKIYHTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrCl2N3O/c11-7-4-2-1-3-6(7)5-17-10-15-8(12)14-9(13)16-10/h1-4H,5H2.
What are the key properties of 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine?
2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine has a molecular weight of 334.99 g/mol, XLogP of 3.52, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methoxy]-4,6-dichloro-1,3,5-triazine is sourced from PubChem (CID 82823763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).