6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline

C17H11Cl2NO — CID 51031204

IUPAC6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline
SMILESClc1ccc2nc3c(c(-c4ccccc4Cl)c2c1)CCO3
InChIInChI=1S/C17H11Cl2NO/c18-10-5-6-15-13(9-10)16(11-3-1-2-4-14(11)19)12-7-8-21-17(12)20-15/h1-6,9H,7-8H2
InChIKeyWSBLFHVZURHTOZ-UHFFFAOYSA-N
MW316.19 g/mol
LogP5.14
Rot. Bonds1

About 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline

6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline (PubChem CID 51031204) has the molecular formula C17H11Cl2NO and a molecular weight of 316.19 g/mol. Its IUPAC name is 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline.

Molecular Properties

Compound Name6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline
PubChem CID51031204
Molecular FormulaC17H11Cl2NO
Molecular Weight316.19 g/mol
Exact Mass315.02
IUPAC Name6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline
SMILESClc1ccc2nc3c(c(-c4ccccc4Cl)c2c1)CCO3
InChIInChI=1S/C17H11Cl2NO/c18-10-5-6-15-13(9-10)16(11-3-1-2-4-14(11)19)12-7-8-21-17(12)20-15/h1-6,9H,7-8H2
InChIKeyWSBLFHVZURHTOZ-UHFFFAOYSA-N
XLogP5.14
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.19
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline?
The IUPAC name of 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline (CID 51031204) is 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline.
What is the SMILES notation for 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline?
The canonical SMILES for 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline is Clc1ccc2nc3c(c(-c4ccccc4Cl)c2c1)CCO3.
What is the InChIKey of 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline?
The InChIKey is WSBLFHVZURHTOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11Cl2NO/c18-10-5-6-15-13(9-10)16(11-3-1-2-4-14(11)19)12-7-8-21-17(12)20-15/h1-6,9H,7-8H2.
What are the key properties of 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline?
6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline has a molecular weight of 316.19 g/mol, XLogP of 5.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(2-chlorophenyl)-2,3-dihydrofuro[2,3-b]quinoline is sourced from PubChem (CID 51031204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).