4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline

C25H18ClN — CID 3736312

IUPAC4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline
SMILESClc1ccc(-c2cc(-c3ccccc3)nc3c2CCc2ccccc2-3)cc1
InChIInChI=1S/C25H18ClN/c26-20-13-10-18(11-14-20)23-16-24(19-7-2-1-3-8-19)27-25-21-9-5-4-6-17(21)12-15-22(23)25/h1-11,13-14,16H,12,15H2
InChIKeyNPCIWTIZYDVVEU-UHFFFAOYSA-N
MW367.88 g/mol
LogP6.83
Rot. Bonds2

About 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline

4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline (PubChem CID 3736312) has the molecular formula C25H18ClN and a molecular weight of 367.88 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline.

Molecular Properties

Compound Name4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline
PubChem CID3736312
Molecular FormulaC25H18ClN
Molecular Weight367.88 g/mol
Exact Mass367.11
IUPAC Name4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline
SMILESClc1ccc(-c2cc(-c3ccccc3)nc3c2CCc2ccccc2-3)cc1
InChIInChI=1S/C25H18ClN/c26-20-13-10-18(11-14-20)23-16-24(19-7-2-1-3-8-19)27-25-21-9-5-4-6-17(21)12-15-22(23)25/h1-11,13-14,16H,12,15H2
InChIKeyNPCIWTIZYDVVEU-UHFFFAOYSA-N
XLogP6.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.88
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-(4-chlorophenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
CID 137175160
4-chloro-2-(4-chlorophenyl)-5,6-dihydrobenzo[h]quinazoline
CID 10639883
4-(4-chlorophenyl)-2-pyridin-2-yl-5H-indeno[1,2-b]pyridine
CID 102085470
4-[4-(3-chlorophenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
CID 137175159
2,4-diphenyl-5H-chromeno[4,3-b]pyridine
CID 5096779
2-(4-chlorophenyl)-4-(4-hydroxyphenyl)-5H-indeno[1,2-b]pyridin-8-ol
CID 155518317
2,4-bis(4-chlorophenyl)-6-phenylpyridine
CID 3640020
3-[4-(3-chlorophenyl)-5H-indeno[1,2-b]pyridin-2-yl]phenol
CID 127032595
4-tert-butyl-6-phenyl-3-azatricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,11,13-hexaene
CID 59295530
4-chloro-2-(4-chlorophenyl)-6-phenylpyrimidine
CID 582047
4-(4-bromophenyl)-2-phenyl-5,6-dihydrobenzo[j][1,7]phenanthroline
CID 134689882
2-(4-bromophenyl)-4-phenyl-5H-chromeno[4,3-b]pyridine
CID 22333272

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline?
The IUPAC name of 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline (CID 3736312) is 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline.
What is the SMILES notation for 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline?
The canonical SMILES for 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline is Clc1ccc(-c2cc(-c3ccccc3)nc3c2CCc2ccccc2-3)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline?
The InChIKey is NPCIWTIZYDVVEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18ClN/c26-20-13-10-18(11-14-20)23-16-24(19-7-2-1-3-8-19)27-25-21-9-5-4-6-17(21)12-15-22(23)25/h1-11,13-14,16H,12,15H2.
What are the key properties of 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline?
4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline has a molecular weight of 367.88 g/mol, XLogP of 6.83, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-2-phenyl-5,6-dihydrobenzo[h]quinoline is sourced from PubChem (CID 3736312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).