5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

C17H9Cl2NO3 — CID 150748551

IUPAC5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1c2oc3c(Cl)cccc3c(=O)c2CN1c1ccc(Cl)cc1
InChIInChI=1S/C17H9Cl2NO3/c18-9-4-6-10(7-5-9)20-8-12-14(21)11-2-1-3-13(19)15(11)23-16(12)17(20)22/h1-7H,8H2
InChIKeyJVJFITGULRLHRG-UHFFFAOYSA-N
MW346.17 g/mol
LogP4.26
Rot. Bonds1

About 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (PubChem CID 150748551) has the molecular formula C17H9Cl2NO3 and a molecular weight of 346.17 g/mol. Its IUPAC name is 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.

Molecular Properties

Compound Name5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
PubChem CID150748551
Molecular FormulaC17H9Cl2NO3
Molecular Weight346.17 g/mol
Exact Mass345.00
IUPAC Name5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
SMILESO=C1c2oc3c(Cl)cccc3c(=O)c2CN1c1ccc(Cl)cc1
InChIInChI=1S/C17H9Cl2NO3/c18-9-4-6-10(7-5-9)20-8-12-14(21)11-2-1-3-13(19)15(11)23-16(12)17(20)22/h1-7H,8H2
InChIKeyJVJFITGULRLHRG-UHFFFAOYSA-N
XLogP4.26
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.17
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The IUPAC name of 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione (CID 150748551) is 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.
What is the SMILES notation for 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The canonical SMILES for 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione is O=C1c2oc3c(Cl)cccc3c(=O)c2CN1c1ccc(Cl)cc1.
What is the InChIKey of 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
The InChIKey is JVJFITGULRLHRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9Cl2NO3/c18-9-4-6-10(7-5-9)20-8-12-14(21)11-2-1-3-13(19)15(11)23-16(12)17(20)22/h1-7H,8H2.
What are the key properties of 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione?
5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione has a molecular weight of 346.17 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(4-chlorophenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione is sourced from PubChem (CID 150748551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).