10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine

C35H25FN2O — CID 176668607

IUPAC10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine
SMILESCc1ccc(-c2cc(-c3ccc(F)cc3)nc3c(N4c5ccccc5Oc5ccccc54)ccc(C)c23)cc1
InChIInChI=1S/C35H25FN2O/c1-22-11-14-24(15-12-22)27-21-28(25-16-18-26(36)19-17-25)37-35-31(20-13-23(2)34(27)35)38-29-7-3-5-9-32(29)39-33-10-6-4-8-30(33)38/h3-21H,1-2H3
InChIKeyPGWTXCDNQJQVMF-UHFFFAOYSA-N
MW508.60 g/mol
LogP9.90
Rot. Bonds3

About 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine

10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine (PubChem CID 176668607) has the molecular formula C35H25FN2O and a molecular weight of 508.60 g/mol. Its IUPAC name is 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine.

Molecular Properties

Compound Name10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine
PubChem CID176668607
Molecular FormulaC35H25FN2O
Molecular Weight508.60 g/mol
Exact Mass508.20
IUPAC Name10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine
SMILESCc1ccc(-c2cc(-c3ccc(F)cc3)nc3c(N4c5ccccc5Oc5ccccc54)ccc(C)c23)cc1
InChIInChI=1S/C35H25FN2O/c1-22-11-14-24(15-12-22)27-21-28(25-16-18-26(36)19-17-25)37-35-31(20-13-23(2)34(27)35)38-29-7-3-5-9-32(29)39-33-10-6-4-8-30(33)38/h3-21H,1-2H3
InChIKeyPGWTXCDNQJQVMF-UHFFFAOYSA-N
XLogP9.90
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.60
LogP ≤ 59.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6,7-Dimethyl-2-(3-phenoxyphenyl)-4-phenylquinoline
CID 134156187
4-Phenyl-3-[4-(4-phenyl-2-quinolyl)phenoxy]-2-(p-tolyl)quinoline
CID 57403885
10-[4-[6,7-Difluoro-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine
CID 139188327
Fdqpxz
CID 145766039
1-[4-(2-Fluorophenylmethoxy)phenyl]-3-phenyl-benzo[f]quinoline
CID 129763937
2-(4-Fluorophenoxy)-3-phenyl-6-(trifluoromethyl)quinoxaline
CID 388004
2-[[4-(4-Fluoro-2-methoxyphenyl)piperazin-1-yl]methyl]quinoline
CID 17954942
1-(4-Fluoro-2-methoxyphenyl)-4-(8-methylquinoline-2-ylmethyl)piperazine
CID 17955113
2-[4-[2-(2,2,2-Trifluoroethoxy)phenyl]-1-piperazinylmethyl]quinoline
CID 69699662
6-Fluoro-2-[4-[2-(2,2,2-trifluoroethoxy)phenyl]-1-piperazinylmethyl]quinoline
CID 69700157
6-Fluoro-2-[[4-(4-fluoro-2-methoxyphenyl)piperazin-1-yl]methyl]quinoline
CID 69973426
6-(9,9-Dimethylacridin-10-yl)-3-fluoro-10-phenoxazin-10-ylphenanthro[9,10-b]pyrazine-2-carbonitrile
CID 118912743

Frequently Asked Questions

What is the IUPAC name of 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine (CID 176668607) is 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine is Cc1ccc(-c2cc(-c3ccc(F)cc3)nc3c(N4c5ccccc5Oc5ccccc54)ccc(C)c23)cc1.
What is the InChIKey of 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine?
The InChIKey is PGWTXCDNQJQVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H25FN2O/c1-22-11-14-24(15-12-22)27-21-28(25-16-18-26(36)19-17-25)37-35-31(20-13-23(2)34(27)35)38-29-7-3-5-9-32(29)39-33-10-6-4-8-30(33)38/h3-21H,1-2H3.
What are the key properties of 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine?
10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine has a molecular weight of 508.60 g/mol, XLogP of 9.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-(4-fluorophenyl)-5-methyl-4-(4-methylphenyl)quinolin-8-yl]phenoxazine is sourced from PubChem (CID 176668607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).