1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline

C101H78N8O2 — CID 159337531

IUPAC1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline
SMILESCc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)N(c1ccccc1)c1ccccc1O2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1cccc2c1N(c1ccccc1)c1ccccc1O2.Cc1ccccc1-c1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/3C21H16N2.2C19H15NO/c1-15-9-5-6-12-17(15)21-22-19-14-8-7-13-18(19)20(23-21)16-10-3-2-4-11-16;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-14-8-7-13-18-19(14)20(15-9-3-2-4-10-15)16-11-5-6-12-17(16)21-18;1-14-11-12-19-17(13-14)20(15-7-3-2-4-8-15)16-9-5-6-10-18(16)21-19/h3*2-14H,1H3;2*2-13H,1H3
InChIKeyLFSQYNWVCSRFMR-UHFFFAOYSA-N
MW1435.79 g/mol
LogP26.96
Rot. Bonds8

About 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline

1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline (PubChem CID 159337531) has the molecular formula C101H78N8O2 and a molecular weight of 1435.79 g/mol. Its IUPAC name is 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline.

Molecular Properties

Compound Name1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline
PubChem CID159337531
Molecular FormulaC101H78N8O2
Molecular Weight1435.79 g/mol
Exact Mass1434.62
IUPAC Name1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline
SMILESCc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)N(c1ccccc1)c1ccccc1O2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1cccc2c1N(c1ccccc1)c1ccccc1O2.Cc1ccccc1-c1nc(-c2ccccc2)c2ccccc2n1
InChIInChI=1S/3C21H16N2.2C19H15NO/c1-15-9-5-6-12-17(15)21-22-19-14-8-7-13-18(19)20(23-21)16-10-3-2-4-11-16;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-14-8-7-13-18-19(14)20(15-9-3-2-4-10-15)16-11-5-6-12-17(16)21-18;1-14-11-12-19-17(13-14)20(15-7-3-2-4-8-15)16-9-5-6-10-18(16)21-19/h3*2-14H,1H3;2*2-13H,1H3
InChIKeyLFSQYNWVCSRFMR-UHFFFAOYSA-N
XLogP26.96
TPSA102.28 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms111
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001435.79
LogP ≤ 526.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline with MolForge

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Related Compounds

14-phenyl-10-(4-phenylquinazolin-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 118216167
10-(2,4-diphenylquinazolin-7-yl)phenoxazine
CID 130396272
14-phenyl-11-(4-phenylquinazolin-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 118216067
14-phenyl-11-[4-(4-phenylphenyl)quinazolin-2-yl]-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 118216060
10-phenyl-2-[7-(4-phenylquinazolin-2-yl)benzo[c]carbazol-11-yl]phenoxazine
CID 134432123
10-[4-[4-(4-phenothiazin-10-ylphenyl)-2-phenylquinazolin-7-yl]phenyl]phenoxazine
CID 130396303
2-(9,9-dimethylacridin-10-yl)-9,9-dimethyl-10-phenyl-7-(4-phenylquinazolin-2-yl)acridine
CID 134579023
2-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-4-yl)-4-phenylquinazoline
CID 164936942
8,14,22-triphenyl-5-[4-(4-phenylquinazolin-2-yl)phenyl]-8,14,22-triaza-1-borahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaene
CID 153293400
1,8-bis[3-(3,5-diphenylphenyl)phenyl]-9-methylcarbazole;1,8-bis[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-methylcarbazole;10-[3-[9-methyl-8-(3-phenoxazin-10-ylphenyl)carbazol-1-yl]phenyl]phenoxazine;10-[4-[9-methyl-8-(4-phenoxazin-10-ylphenyl)carbazol-1-yl]phenyl]phenoxazine
CID 157430617
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-12-oxa-5,16-diazahexacyclo[15.7.1.02,15.04,13.06,11.021,25]pentacosa-1(24),2,4(13),6,8,10,14,17,19,21(25),22-undecaene
CID 163774065
3-methylfluoranthene;3-(4-methylphenyl)fluoranthene;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline;2-methyl-4-phenylquinazoline;3-methyl-9-(4-phenylquinazolin-2-yl)carbazole;toluene
CID 158272627

Frequently Asked Questions

What is the IUPAC name of 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline?
The IUPAC name of 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline (CID 159337531) is 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline.
What is the SMILES notation for 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline?
The canonical SMILES for 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline is Cc1ccc(-c2nc(-c3ccccc3)c3ccccc3n2)cc1.Cc1ccc2c(c1)N(c1ccccc1)c1ccccc1O2.Cc1cccc(-c2nc(-c3ccccc3)c3ccccc3n2)c1.Cc1cccc2c1N(c1ccccc1)c1ccccc1O2.Cc1ccccc1-c1nc(-c2ccccc2)c2ccccc2n1.
What is the InChIKey of 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline?
The InChIKey is LFSQYNWVCSRFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/3C21H16N2.2C19H15NO/c1-15-9-5-6-12-17(15)21-22-19-14-8-7-13-18(19)20(23-21)16-10-3-2-4-11-16;1-15-8-7-11-17(14-15)21-22-19-13-6-5-12-18(19)20(23-21)16-9-3-2-4-10-16;1-15-11-13-17(14-12-15)21-22-19-10-6-5-9-18(19)20(23-21)16-7-3-2-4-8-16;1-14-8-7-13-18-19(14)20(15-9-3-2-4-10-15)16-11-5-6-12-17(16)21-18;1-14-11-12-19-17(13-14)20(15-7-3-2-4-8-15)16-9-5-6-10-18(16)21-19/h3*2-14H,1H3;2*2-13H,1H3.
What are the key properties of 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline?
1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline has a molecular weight of 1435.79 g/mol, XLogP of 26.96, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-10-phenylphenoxazine;2-methyl-10-phenylphenoxazine;2-(2-methylphenyl)-4-phenylquinazoline;2-(3-methylphenyl)-4-phenylquinazoline;2-(4-methylphenyl)-4-phenylquinazoline is sourced from PubChem (CID 159337531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).