7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline

C23H18N4O2 — CID 90040214

IUPAC7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline
SMILESCOc1ccccc1-c1cc2nnc3[nH]ncc3c2cc1-c1ccccc1OC
InChIInChI=1S/C23H18N4O2/c1-28-21-9-5-3-7-14(21)16-11-18-19-13-24-26-23(19)27-25-20(18)12-17(16)15-8-4-6-10-22(15)29-2/h3-13H,1-2H3,(H,24,26,27)
InChIKeyNQRMTNSTRXVFNC-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.86
Rot. Bonds4

About 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline

7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline (PubChem CID 90040214) has the molecular formula C23H18N4O2 and a molecular weight of 382.42 g/mol. Its IUPAC name is 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline.

Molecular Properties

Compound Name7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline
PubChem CID90040214
Molecular FormulaC23H18N4O2
Molecular Weight382.42 g/mol
Exact Mass382.14
IUPAC Name7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline
SMILESCOc1ccccc1-c1cc2nnc3[nH]ncc3c2cc1-c1ccccc1OC
InChIInChI=1S/C23H18N4O2/c1-28-21-9-5-3-7-14(21)16-11-18-19-13-24-26-23(19)27-25-20(18)12-17(16)15-8-4-6-10-22(15)29-2/h3-13H,1-2H3,(H,24,26,27)
InChIKeyNQRMTNSTRXVFNC-UHFFFAOYSA-N
XLogP4.86
TPSA72.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7,8-dimethoxy-3H-pyrazolo[5,4-c]cinnoline;hydrochloride
CID 90485964
5-bromo-4-(2-methoxyphenyl)-1H-pyrazole
CID 84707753
4-(2-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-1H-pyrazole
CID 174686401
6-benzyl-7,8-dimethoxy-3H-pyrazolo[5,4-c]cinnoline
CID 90041141
4-(2-methoxyphenyl)-1H-pyrazole-5-carbaldehyde
CID 105422977
5-(2-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1H-pyrazole
CID 174686402
1-[4-(2-methoxyphenyl)-1H-pyrazol-5-yl]ethanamine
CID 105423244
5-(2-methoxyphenyl)-1H-pyrazol-4-amine;hydrochloride
CID 13303418
3-[4-(2-methoxyphenyl)-1H-pyrazol-5-yl]aniline
CID 73335294
5-(2-methoxyphenyl)-1H-pyrazole-4-carbaldehyde
CID 4067971
2-(4-methyl-1H-pyrazolo[3,4-c]pyridazin-5-yl)phenol
CID 171826738
3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 156565673

Frequently Asked Questions

What is the IUPAC name of 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline?
The IUPAC name of 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline (CID 90040214) is 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline.
What is the SMILES notation for 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline?
The canonical SMILES for 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline is COc1ccccc1-c1cc2nnc3[nH]ncc3c2cc1-c1ccccc1OC.
What is the InChIKey of 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline?
The InChIKey is NQRMTNSTRXVFNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2/c1-28-21-9-5-3-7-14(21)16-11-18-19-13-24-26-23(19)27-25-20(18)12-17(16)15-8-4-6-10-22(15)29-2/h3-13H,1-2H3,(H,24,26,27).
What are the key properties of 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline?
7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline has a molecular weight of 382.42 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-bis(2-methoxyphenyl)-3H-pyrazolo[5,4-c]cinnoline is sourced from PubChem (CID 90040214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).