10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine

C43H30N2O — CID 166084544

IUPAC10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)cc1-c1cc(-c2ccccc2)cc2c1[nH]c1ccc(-c3ccccc3)cc12
InChIInChI=1S/C43H30N2O/c1-28-20-22-33(45-39-16-8-10-18-41(39)46-42-19-11-9-17-40(42)45)27-34(28)36-25-32(30-14-6-3-7-15-30)26-37-35-24-31(29-12-4-2-5-13-29)21-23-38(35)44-43(36)37/h2-27,44H,1H3
InChIKeyVYCCGFXQGQNYHV-UHFFFAOYSA-N
MW590.73 g/mol
LogP12.21
Rot. Bonds4

About 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine

10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine (PubChem CID 166084544) has the molecular formula C43H30N2O and a molecular weight of 590.73 g/mol. Its IUPAC name is 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine.

Molecular Properties

Compound Name10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine
PubChem CID166084544
Molecular FormulaC43H30N2O
Molecular Weight590.73 g/mol
Exact Mass590.24
IUPAC Name10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)cc1-c1cc(-c2ccccc2)cc2c1[nH]c1ccc(-c3ccccc3)cc12
InChIInChI=1S/C43H30N2O/c1-28-20-22-33(45-39-16-8-10-18-41(39)46-42-19-11-9-17-40(42)45)27-34(28)36-25-32(30-14-6-3-7-15-30)26-37-35-24-31(29-12-4-2-5-13-29)21-23-38(35)44-43(36)37/h2-27,44H,1H3
InChIKeyVYCCGFXQGQNYHV-UHFFFAOYSA-N
XLogP12.21
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.73
LogP ≤ 512.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3,6-triphenyl-9H-carbazole
CID 118052457
10-[4-[8-(4-phenoxazin-10-ylphenyl)-3,6,9-triphenylcarbazol-1-yl]phenyl]phenoxazine
CID 139312569
10-[3,4-bis(4-methylphenyl)phenyl]phenoxazine
CID 58251267
10-(4-methylphenyl)-3,7-diphenylphenoxazine
CID 58556205
10-(4-dibenzothiophen-2-ylphenyl)-3,7-dimethylphenoxazine;10-(4-dibenzothiophen-2-ylphenyl)-3,7-diphenylphenoxazine;10-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-3-methyl-7-phenylphenoxazine;10-[4-(4-dibenzothiophen-2-ylphenyl)phenyl]-3-(4-phenylphenyl)phenoxazine
CID 160540882
10-[10-(3-phenylphenyl)phenanthro[9,10-b]pyrazin-7-yl]phenoxazine
CID 118912208
10-(3-phenyl-9,9'-spirobi[xanthene]-3'-yl)phenoxazine
CID 118698598
10-phenyl-3-[4-(3-phenylphenyl)phenyl]phenoxazine
CID 155186108
3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
2-phenyl-5-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthridin-6-one
CID 137401641
10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134475798
N-[4-(3-phenoxazin-10-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 122425440

Frequently Asked Questions

What is the IUPAC name of 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine?
The IUPAC name of 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine (CID 166084544) is 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine.
What is the SMILES notation for 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine?
The canonical SMILES for 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine is Cc1ccc(N2c3ccccc3Oc3ccccc32)cc1-c1cc(-c2ccccc2)cc2c1[nH]c1ccc(-c3ccccc3)cc12.
What is the InChIKey of 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine?
The InChIKey is VYCCGFXQGQNYHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2O/c1-28-20-22-33(45-39-16-8-10-18-41(39)46-42-19-11-9-17-40(42)45)27-34(28)36-25-32(30-14-6-3-7-15-30)26-37-35-24-31(29-12-4-2-5-13-29)21-23-38(35)44-43(36)37/h2-27,44H,1H3.
What are the key properties of 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine?
10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine has a molecular weight of 590.73 g/mol, XLogP of 12.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(3,6-diphenyl-9H-carbazol-1-yl)-4-methylphenyl]phenoxazine is sourced from PubChem (CID 166084544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).