3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine

C15H11Cl2N3O2 — CID 170793879

IUPAC3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine
SMILESCOc1ccc(COc2nc3cc(Cl)ncc3nc2Cl)cc1
InChIInChI=1S/C15H11Cl2N3O2/c1-21-10-4-2-9(3-5-10)8-22-15-14(17)19-12-7-18-13(16)6-11(12)20-15/h2-7H,8H2,1H3
InChIKeyUMLVIPXEPBWFLA-UHFFFAOYSA-N
MW336.18 g/mol
LogP3.92
Rot. Bonds4

About 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine

3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine (PubChem CID 170793879) has the molecular formula C15H11Cl2N3O2 and a molecular weight of 336.18 g/mol. Its IUPAC name is 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine.

Molecular Properties

Compound Name3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine
PubChem CID170793879
Molecular FormulaC15H11Cl2N3O2
Molecular Weight336.18 g/mol
Exact Mass335.02
IUPAC Name3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine
SMILESCOc1ccc(COc2nc3cc(Cl)ncc3nc2Cl)cc1
InChIInChI=1S/C15H11Cl2N3O2/c1-21-10-4-2-9(3-5-10)8-22-15-14(17)19-12-7-18-13(16)6-11(12)20-15/h2-7H,8H2,1H3
InChIKeyUMLVIPXEPBWFLA-UHFFFAOYSA-N
XLogP3.92
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.18
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine with MolForge

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

Launch Full Analysis

Related Compounds

2,5-dichloro-6-[(4-methoxyphenyl)methoxy]-3-(trifluoromethyl)pyridine
CID 134106504
3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine
CID 22607567
(4-methoxyphenyl)methyl 2,5-dichloropyridine-4-carboxylate
CID 114929193
4-chloro-2,6-bis[(4-methoxyphenyl)methoxy]-5-propan-2-ylpyrimidine
CID 59184713
2-chloro-1-ethenyl-4-[(4-methoxyphenyl)methoxy]benzene
CID 134457948
3-chloro-7-methoxyisoquinoline
CID 53425565
6-chloro-2-[(4-methoxyphenyl)methoxy]-3-nitropyridine
CID 43330217
3-chloro-6-methoxyisoquinoline
CID 53407774
2-chloro-5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]pyrazine
CID 170721271
2-chloro-4-[(4-methoxyphenyl)methoxy]benzaldehyde
CID 89247022
5-iodo-4-[(4-methoxyphenyl)methoxy]pyrimidine
CID 66317781
CID 170968311
CID 170968311

Frequently Asked Questions

What is the IUPAC name of 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine?
The IUPAC name of 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine (CID 170793879) is 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine.
What is the SMILES notation for 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine?
The canonical SMILES for 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine is COc1ccc(COc2nc3cc(Cl)ncc3nc2Cl)cc1.
What is the InChIKey of 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine?
The InChIKey is UMLVIPXEPBWFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O2/c1-21-10-4-2-9(3-5-10)8-22-15-14(17)19-12-7-18-13(16)6-11(12)20-15/h2-7H,8H2,1H3.
What are the key properties of 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine?
3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine has a molecular weight of 336.18 g/mol, XLogP of 3.92, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dichloro-2-[(4-methoxyphenyl)methoxy]pyrido[3,4-b]pyrazine is sourced from PubChem (CID 170793879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).