1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline

C22H23N3O3 — CID 70976924

IUPAC1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline
SMILESCCOc1nc2ccccc2c2c(OCC)n(Cc3ccc(OC)cc3)nc12
InChIInChI=1S/C22H23N3O3/c1-4-27-21-20-19(17-8-6-7-9-18(17)23-21)22(28-5-2)25(24-20)14-15-10-12-16(26-3)13-11-15/h6-13H,4-5,14H2,1-3H3
InChIKeyLBDBHLGVIHFBEJ-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.44
Rot. Bonds7

About 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline

1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline (PubChem CID 70976924) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline.

Molecular Properties

Compound Name1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline
PubChem CID70976924
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline
SMILESCCOc1nc2ccccc2c2c(OCC)n(Cc3ccc(OC)cc3)nc12
InChIInChI=1S/C22H23N3O3/c1-4-27-21-20-19(17-8-6-7-9-18(17)23-21)22(28-5-2)25(24-20)14-15-10-12-16(26-3)13-11-15/h6-13H,4-5,14H2,1-3H3
InChIKeyLBDBHLGVIHFBEJ-UHFFFAOYSA-N
XLogP4.44
TPSA58.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline 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

3-methoxy-1-[(4-methoxyphenyl)methyl]indazole
CID 174608051
2-[(4-methoxyphenyl)methyl]-3-(4-methylphenyl)indazole
CID 11645597
3-[(4-methoxyphenyl)methoxy]-1-[(4-methoxyphenyl)methyl]indazole
CID 51357040
2-[(4-methoxyphenyl)methyl]benzotriazole
CID 3828598
4-bromo-2-[(4-methoxyphenyl)methyl]triazolo[4,5-c]quinoline
CID 160646300
4-tert-butyl-3-ethoxy-1-[(4-methoxyphenyl)methyl]pyrazolo[3,4-b]pyridine
CID 90869563
3-[(4-methoxyphenyl)methyl]-2-(2-phenylethylsulfanyl)quinazolin-4-one
CID 51365408
2-(2-ethoxyethylsulfanyl)-3-[(4-methoxyphenyl)methyl]quinazolin-4-one
CID 8634246
4-ethoxy-2-(2-phenylethyl)quinazoline
CID 132571184
4-chloro-1-methyl-2-propylpyrazolo[3,4-c]quinoline
CID 11842676
7-chloro-3-(4-methoxyphenyl)-2-propylindazole
CID 68882476
2-(4-methoxyphenyl)-1,4-diphenylpyrazolo[3,4-c]quinoline
CID 132918864

Frequently Asked Questions

What is the IUPAC name of 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline?
The IUPAC name of 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline (CID 70976924) is 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline.
What is the SMILES notation for 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline?
The canonical SMILES for 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline is CCOc1nc2ccccc2c2c(OCC)n(Cc3ccc(OC)cc3)nc12.
What is the InChIKey of 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline?
The InChIKey is LBDBHLGVIHFBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-4-27-21-20-19(17-8-6-7-9-18(17)23-21)22(28-5-2)25(24-20)14-15-10-12-16(26-3)13-11-15/h6-13H,4-5,14H2,1-3H3.
What are the key properties of 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline?
1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline has a molecular weight of 377.44 g/mol, XLogP of 4.44, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethoxy-2-[(4-methoxyphenyl)methyl]pyrazolo[3,4-c]quinoline is sourced from PubChem (CID 70976924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).