6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione

C24H20Cl2N2O5 — CID 134469751

IUPAC6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione
SMILESCC(C)OCC1(C)OC2=C(C1=O)C1(C(=O)Nc3cc(Cl)ccc31)N(c1cccc(Cl)c1)C2=O
InChIInChI=1S/C24H20Cl2N2O5/c1-12(2)32-11-23(3)20(29)18-19(33-23)21(30)28(15-6-4-5-13(25)9-15)24(18)16-8-7-14(26)10-17(16)27-22(24)31/h4-10,12H,11H2,1-3H3,(H,27,31)
InChIKeyAQMHJQFXHKXXQU-UHFFFAOYSA-N
MW487.34 g/mol
LogP4.22
Rot. Bonds4

About 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione

6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione (PubChem CID 134469751) has the molecular formula C24H20Cl2N2O5 and a molecular weight of 487.34 g/mol. Its IUPAC name is 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione.

Molecular Properties

Compound Name6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione
PubChem CID134469751
Molecular FormulaC24H20Cl2N2O5
Molecular Weight487.34 g/mol
Exact Mass486.07
IUPAC Name6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione
SMILESCC(C)OCC1(C)OC2=C(C1=O)C1(C(=O)Nc3cc(Cl)ccc31)N(c1cccc(Cl)c1)C2=O
InChIInChI=1S/C24H20Cl2N2O5/c1-12(2)32-11-23(3)20(29)18-19(33-23)21(30)28(15-6-4-5-13(25)9-15)24(18)16-8-7-14(26)10-17(16)27-22(24)31/h4-10,12H,11H2,1-3H3,(H,27,31)
InChIKeyAQMHJQFXHKXXQU-UHFFFAOYSA-N
XLogP4.22
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.34
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione?
The IUPAC name of 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione (CID 134469751) is 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione.
What is the SMILES notation for 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione?
The canonical SMILES for 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione is CC(C)OCC1(C)OC2=C(C1=O)C1(C(=O)Nc3cc(Cl)ccc31)N(c1cccc(Cl)c1)C2=O.
What is the InChIKey of 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione?
The InChIKey is AQMHJQFXHKXXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20Cl2N2O5/c1-12(2)32-11-23(3)20(29)18-19(33-23)21(30)28(15-6-4-5-13(25)9-15)24(18)16-8-7-14(26)10-17(16)27-22(24)31/h4-10,12H,11H2,1-3H3,(H,27,31).
What are the key properties of 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione?
6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione has a molecular weight of 487.34 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5'-(3-chlorophenyl)-2'-methyl-2'-(propan-2-yloxymethyl)spiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione is sourced from PubChem (CID 134469751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).