2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine

C10H6Br2ClN3O2 — CID 64718654

IUPAC2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(Br)cc2Br)n1
InChIInChI=1S/C10H6Br2ClN3O2/c1-17-9-14-8(13)15-10(16-9)18-7-3-2-5(11)4-6(7)12/h2-4H,1H3
InChIKeyZUPVOSFLAGTCKQ-UHFFFAOYSA-N
MW395.44 g/mol
LogP3.85
Rot. Bonds3

About 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine

2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine (PubChem CID 64718654) has the molecular formula C10H6Br2ClN3O2 and a molecular weight of 395.44 g/mol. Its IUPAC name is 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine.

Molecular Properties

Compound Name2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine
PubChem CID64718654
Molecular FormulaC10H6Br2ClN3O2
Molecular Weight395.44 g/mol
Exact Mass392.85
IUPAC Name2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine
SMILESCOc1nc(Cl)nc(Oc2ccc(Br)cc2Br)n1
InChIInChI=1S/C10H6Br2ClN3O2/c1-17-9-14-8(13)15-10(16-9)18-7-3-2-5(11)4-6(7)12/h2-4H,1H3
InChIKeyZUPVOSFLAGTCKQ-UHFFFAOYSA-N
XLogP3.85
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.44
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]aniline
CID 65431100
2-chloro-4-(2,4-dibromophenoxy)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 64719973
4-(2-bromo-4-methoxyphenoxy)-6-chloro-N,N-dimethyl-1,3,5-triazin-2-amine
CID 104707062
5-bromo-2-(2,4-dibromophenoxy)-4-methoxypyrimidine
CID 106999331
2-(4-bromo-2-chlorophenoxy)-4-chloro-6-propan-2-yloxy-1,3,5-triazine
CID 62869293
2-(4-bromo-2-propan-2-ylphenoxy)-4-chloro-6-ethoxy-1,3,5-triazine
CID 115401784
2,3,5-trichloro-6-(2,4-dibromophenoxy)pyridine
CID 102749707
2-chloro-3-(2,4-dibromophenoxy)pyrazine
CID 64719536
6-(2,4-dibromophenoxy)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80877262
[4-(2-bromo-4-methoxyphenoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 104708873
2-chloro-4-(4-chloro-2-nitrophenoxy)-6-methoxy-1,3,5-triazine
CID 62859653
4-(2,4-dibromophenoxy)-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80871301

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine?
The IUPAC name of 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine (CID 64718654) is 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine.
What is the SMILES notation for 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine?
The canonical SMILES for 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine is COc1nc(Cl)nc(Oc2ccc(Br)cc2Br)n1.
What is the InChIKey of 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine?
The InChIKey is ZUPVOSFLAGTCKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2ClN3O2/c1-17-9-14-8(13)15-10(16-9)18-7-3-2-5(11)4-6(7)12/h2-4H,1H3.
What are the key properties of 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine?
2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine has a molecular weight of 395.44 g/mol, XLogP of 3.85, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(2,4-dibromophenoxy)-6-methoxy-1,3,5-triazine is sourced from PubChem (CID 64718654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).