10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

C38H25ClN2O — CID 176668733

IUPAC10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(Cl)cc3)cc(-c3cccc4ccccc34)c12
InChIInChI=1S/C38H25ClN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3
InChIKeyGIGOJUOPDXJBCR-UHFFFAOYSA-N
MW561.08 g/mol
LogP11.26
Rot. Bonds3

About 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (PubChem CID 176668733) has the molecular formula C38H25ClN2O and a molecular weight of 561.08 g/mol. Its IUPAC name is 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.

Molecular Properties

Compound Name10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
PubChem CID176668733
Molecular FormulaC38H25ClN2O
Molecular Weight561.08 g/mol
Exact Mass560.17
IUPAC Name10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(Cl)cc3)cc(-c3cccc4ccccc34)c12
InChIInChI=1S/C38H25ClN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3
InChIKeyGIGOJUOPDXJBCR-UHFFFAOYSA-N
XLogP11.26
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.08
LogP ≤ 511.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
CID 176669028
ethyl 4-[5-methyl-4-naphthalen-1-yl-8-(10-phenylphenazin-5-yl)quinolin-2-yl]benzoate
CID 176668908
10-[2-(4-chlorophenyl)-4-(4-methoxyphenyl)-5-methylquinolin-8-yl]phenoselenazine
CID 176668973
methyl 4-[4-(4-tert-butylphenyl)-5-methyl-8-phenoxazin-10-ylquinolin-2-yl]benzoate
CID 176668849
10-[9-(3,4-dimethylphenyl)-10-naphthalen-1-yl-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59220321
10-[9-(9,9-dimethylfluoren-2-yl)-10-(2-naphthalen-1-ylphenyl)-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59219822
10-[5-methyl-4-phenyl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenothiazine
CID 176668748
10-[2-(4-fluorophenyl)-4-(4-methoxyphenyl)-5-methylquinolin-8-yl]phenothiazine
CID 176668897
5-[4-naphthalen-1-yl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]-10-phenylphenazine
CID 176668846
4-[4-naphthalen-1-yl-8-(10-phenylphenazin-5-yl)quinolin-2-yl]benzoic acid
CID 176669029
8,8,14,14-tetramethyl-5-(2-naphthalen-1-ylphenyl)-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaene
CID 70892961
5-[2-(4-fluorophenyl)-5-methyl-4-thiophen-2-ylquinolin-8-yl]-10-phenylphenazine
CID 176668683

Frequently Asked Questions

What is the IUPAC name of 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (CID 176668733) is 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is Cc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(Cl)cc3)cc(-c3cccc4ccccc34)c12.
What is the InChIKey of 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The InChIKey is GIGOJUOPDXJBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25ClN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3.
What are the key properties of 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine has a molecular weight of 561.08 g/mol, XLogP of 11.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is sourced from PubChem (CID 176668733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).