9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline

C22H14ClNO — CID 2462032

IUPAC9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline
SMILESClc1ccc2nc3c(c(-c4ccccc4)c2c1)COc1ccccc1-3
InChIInChI=1S/C22H14ClNO/c23-15-10-11-19-17(12-15)21(14-6-2-1-3-7-14)18-13-25-20-9-5-4-8-16(20)22(18)24-19/h1-12H,13H2
InChIKeyFOPIBASIMRLVAA-UHFFFAOYSA-N
MW343.81 g/mol
LogP6.11
Rot. Bonds1

About 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline

9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline (PubChem CID 2462032) has the molecular formula C22H14ClNO and a molecular weight of 343.81 g/mol. Its IUPAC name is 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline.

Molecular Properties

Compound Name9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline
PubChem CID2462032
Molecular FormulaC22H14ClNO
Molecular Weight343.81 g/mol
Exact Mass343.08
IUPAC Name9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline
SMILESClc1ccc2nc3c(c(-c4ccccc4)c2c1)COc1ccccc1-3
InChIInChI=1S/C22H14ClNO/c23-15-10-11-19-17(12-15)21(14-6-2-1-3-7-14)18-13-25-20-9-5-4-8-16(20)22(18)24-19/h1-12H,13H2
InChIKeyFOPIBASIMRLVAA-UHFFFAOYSA-N
XLogP6.11
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.81
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-chloro-6H-chromeno[4,3-b]quinoline-3,9-diol
CID 135466468
9-Phenoxyacridine
CID 100640
5-[2-[4-[(2,5-Dichlorophenyl)methyl]piperazin-1-yl]ethoxy]-2-methylquinoline
CID 10238160
7-(3-chlorophenyl)-6H-chromeno[4,3-b]quinoline-3,9-diol
CID 135399711
7-(4-chlorophenyl)-6H-chromeno[4,3-b]quinoline-3,9-diol
CID 135461031
6-Chloro-3-(3,4-dimethoxyphenyl)-2-methyl-4-phenylquinoline
CID 2809389
4-Ethoxy-2-phenylquinoline
CID 14954061
2-Chloro-6-methoxy-3-phenylquinoline
CID 5329279
6-Chloro-2-methoxy-9-phenoxyacridine
CID 345321
2-Chloro-7-methoxy-4-methylquinoline
CID 732214
2-Chloro-4-methoxyquinoline
CID 12369166
Cambridge id 6788307
CID 2790572

Frequently Asked Questions

What is the IUPAC name of 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline?
The IUPAC name of 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline (CID 2462032) is 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline.
What is the SMILES notation for 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline?
The canonical SMILES for 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline is Clc1ccc2nc3c(c(-c4ccccc4)c2c1)COc1ccccc1-3.
What is the InChIKey of 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline?
The InChIKey is FOPIBASIMRLVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14ClNO/c23-15-10-11-19-17(12-15)21(14-6-2-1-3-7-14)18-13-25-20-9-5-4-8-16(20)22(18)24-19/h1-12H,13H2.
What are the key properties of 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline?
9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline has a molecular weight of 343.81 g/mol, XLogP of 6.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-7-phenyl-6H-chromeno[4,3-b]quinoline is sourced from PubChem (CID 2462032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).