7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

C32H25NO4 — CID 18858005

IUPAC7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESCc1ccc(N2C(=O)c3oc4ccc(C)cc4c(=O)c3C2c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C32H25NO4/c1-20-11-14-24(15-12-20)33-29(23-9-6-10-25(18-23)36-19-22-7-4-3-5-8-22)28-30(34)26-17-21(2)13-16-27(26)37-31(28)32(33)35/h3-18,29H,19H2,1-2H3
InChIKeyCPZMHTMMUFIGRT-UHFFFAOYSA-N
MW487.56 g/mol
LogP6.74
Rot. Bonds5

About 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (PubChem CID 18858005) has the molecular formula C32H25NO4 and a molecular weight of 487.56 g/mol. Its IUPAC name is 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.

Molecular Properties

Compound Name7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
PubChem CID18858005
Molecular FormulaC32H25NO4
Molecular Weight487.56 g/mol
Exact Mass487.18
IUPAC Name7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESCc1ccc(N2C(=O)c3oc4ccc(C)cc4c(=O)c3C2c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C32H25NO4/c1-20-11-14-24(15-12-20)33-29(23-9-6-10-25(18-23)36-19-22-7-4-3-5-8-22)28-30(34)26-17-21(2)13-16-27(26)37-31(28)32(33)35/h3-18,29H,19H2,1-2H3
InChIKeyCPZMHTMMUFIGRT-UHFFFAOYSA-N
XLogP6.74
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.56
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The IUPAC name of 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (CID 18858005) is 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.
What is the SMILES notation for 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The canonical SMILES for 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione is Cc1ccc(N2C(=O)c3oc4ccc(C)cc4c(=O)c3C2c2cccc(OCc3ccccc3)c2)cc1.
What is the InChIKey of 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The InChIKey is CPZMHTMMUFIGRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H25NO4/c1-20-11-14-24(15-12-20)33-29(23-9-6-10-25(18-23)36-19-22-7-4-3-5-8-22)28-30(34)26-17-21(2)13-16-27(26)37-31(28)32(33)35/h3-18,29H,19H2,1-2H3.
What are the key properties of 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione has a molecular weight of 487.56 g/mol, XLogP of 6.74, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(4-methylphenyl)-1-(3-phenylmethoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione is sourced from PubChem (CID 18858005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).