4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione

C31H23Cl2NO2 — CID 23802267

IUPAC4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
SMILESO=C1CC(c2ccccc2)CC2=C1C(c1c(Cl)cccc1Cl)CC(=O)N2c1cccc2ccccc12
InChIInChI=1S/C31H23Cl2NO2/c32-24-13-7-14-25(33)30(24)23-18-29(36)34(26-15-6-11-20-10-4-5-12-22(20)26)27-16-21(17-28(35)31(23)27)19-8-2-1-3-9-19/h1-15,21,23H,16-18H2
InChIKeyJPXLYVFVGQOVPH-UHFFFAOYSA-N
MW512.44 g/mol
LogP8.07
Rot. Bonds3

About 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione

4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione (PubChem CID 23802267) has the molecular formula C31H23Cl2NO2 and a molecular weight of 512.44 g/mol. Its IUPAC name is 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione.

Molecular Properties

Compound Name4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
PubChem CID23802267
Molecular FormulaC31H23Cl2NO2
Molecular Weight512.44 g/mol
Exact Mass511.11
IUPAC Name4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
SMILESO=C1CC(c2ccccc2)CC2=C1C(c1c(Cl)cccc1Cl)CC(=O)N2c1cccc2ccccc12
InChIInChI=1S/C31H23Cl2NO2/c32-24-13-7-14-25(33)30(24)23-18-29(36)34(26-15-6-11-20-10-4-5-12-22(20)26)27-16-21(17-28(35)31(23)27)19-8-2-1-3-9-19/h1-15,21,23H,16-18H2
InChIKeyJPXLYVFVGQOVPH-UHFFFAOYSA-N
XLogP8.07
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.44
LogP ≤ 58.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione with MolForge

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Related Compounds

4-[4-(2,6-dichlorophenyl)-2,5-dioxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzenesulfonamide
CID 25045338
4-(2,3-dichlorophenyl)-1-(2-fluorophenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23998972
4-(2,3-dichlorophenyl)-1-(2,3-dimethylphenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23887196
1-(2,3-dimethylphenyl)-4-(2-methylphenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23915283
9-(3,4-dimethoxyphenyl)-10-naphthalen-1-yl-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
CID 139234919
4-(2,4-dichlorophenyl)-1-naphthalen-2-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23915261
4-[4-(2,3-dichlorophenyl)-2,5-dioxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzenesulfonamide
CID 25042120
1-(4-chlorophenyl)-4-(2,6-dichlorophenyl)-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23859455
4-chloro-3-[4-(2-methoxyphenyl)-2,5-dioxo-7-phenyl-4,6,7,8-tetrahydro-3H-quinolin-1-yl]benzoic acid
CID 23887217
4-(4-methoxyphenyl)-1-(4-phenoxyphenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23743938
1-(2-chlorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 121238704
4-(2,3-dimethoxyphenyl)-1-(3-methoxyphenyl)-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione
CID 23998976

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione?
The IUPAC name of 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione (CID 23802267) is 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione.
What is the SMILES notation for 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione?
The canonical SMILES for 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione is O=C1CC(c2ccccc2)CC2=C1C(c1c(Cl)cccc1Cl)CC(=O)N2c1cccc2ccccc12.
What is the InChIKey of 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione?
The InChIKey is JPXLYVFVGQOVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23Cl2NO2/c32-24-13-7-14-25(33)30(24)23-18-29(36)34(26-15-6-11-20-10-4-5-12-22(20)26)27-16-21(17-28(35)31(23)27)19-8-2-1-3-9-19/h1-15,21,23H,16-18H2.
What are the key properties of 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione?
4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione has a molecular weight of 512.44 g/mol, XLogP of 8.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichlorophenyl)-1-naphthalen-1-yl-7-phenyl-4,6,7,8-tetrahydro-3H-quinoline-2,5-dione is sourced from PubChem (CID 23802267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).