10-(4-methylphenyl)-3,7-diphenylphenoxazine

C31H23NO — CID 58556205

IUPAC10-(4-methylphenyl)-3,7-diphenylphenoxazine
SMILESCc1ccc(N2c3ccc(-c4ccccc4)cc3Oc3cc(-c4ccccc4)ccc32)cc1
InChIInChI=1S/C31H23NO/c1-22-12-16-27(17-13-22)32-28-18-14-25(23-8-4-2-5-9-23)20-30(28)33-31-21-26(15-19-29(31)32)24-10-6-3-7-11-24/h2-21H,1H3
InChIKeyDPNFSLLZPXIIAP-UHFFFAOYSA-N
MW425.53 g/mol
LogP8.90
Rot. Bonds3

About 10-(4-methylphenyl)-3,7-diphenylphenoxazine

10-(4-methylphenyl)-3,7-diphenylphenoxazine (PubChem CID 58556205) has the molecular formula C31H23NO and a molecular weight of 425.53 g/mol. Its IUPAC name is 10-(4-methylphenyl)-3,7-diphenylphenoxazine.

Molecular Properties

Compound Name10-(4-methylphenyl)-3,7-diphenylphenoxazine
PubChem CID58556205
Molecular FormulaC31H23NO
Molecular Weight425.53 g/mol
Exact Mass425.18
IUPAC Name10-(4-methylphenyl)-3,7-diphenylphenoxazine
SMILESCc1ccc(N2c3ccc(-c4ccccc4)cc3Oc3cc(-c4ccccc4)ccc32)cc1
InChIInChI=1S/C31H23NO/c1-22-12-16-27(17-13-22)32-28-18-14-25(23-8-4-2-5-9-23)20-30(28)33-31-21-26(15-19-29(31)32)24-10-6-3-7-11-24/h2-21H,1H3
InChIKeyDPNFSLLZPXIIAP-UHFFFAOYSA-N
XLogP8.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.53
LogP ≤ 58.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10-phenyl-3-[4-(3-phenylphenyl)phenyl]phenoxazine
CID 155186108
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-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134475798
10-(2,6-diphenylphenyl)-3,7-bis(4-phenylphenyl)phenoxazine
CID 140898462
10-(4-methoxyphenyl)-3,7-bis(10-phenylanthracen-9-yl)phenoxazine
CID 59302133
2-phenyl-5-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthridin-6-one
CID 137401641
3,7-dimethyl-10-(2-phenylphenyl)phenoxazine
CID 59573736
5-[3-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)-5-phenylphenyl]-8,14-dioxa-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 134552129
10-[4-(5-naphthalen-2-yl-1,2,4-thiadiazol-3-yl)phenyl]-3,7-diphenylphenoxazine
CID 146533940
10-[3,4-bis(4-methylphenyl)phenyl]phenoxazine
CID 58251267
8-methyl-5-phenylpyrido[3,4-b][1,4]benzoxazine
CID 135159317
3-methyl-9-phenylcarbazole;9-(4-methylphenyl)carbazole;3-methyl-10-phenylphenoxazine;10-(4-methylphenyl)phenoxazine
CID 163970379

Frequently Asked Questions

What is the IUPAC name of 10-(4-methylphenyl)-3,7-diphenylphenoxazine?
The IUPAC name of 10-(4-methylphenyl)-3,7-diphenylphenoxazine (CID 58556205) is 10-(4-methylphenyl)-3,7-diphenylphenoxazine.
What is the SMILES notation for 10-(4-methylphenyl)-3,7-diphenylphenoxazine?
The canonical SMILES for 10-(4-methylphenyl)-3,7-diphenylphenoxazine is Cc1ccc(N2c3ccc(-c4ccccc4)cc3Oc3cc(-c4ccccc4)ccc32)cc1.
What is the InChIKey of 10-(4-methylphenyl)-3,7-diphenylphenoxazine?
The InChIKey is DPNFSLLZPXIIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23NO/c1-22-12-16-27(17-13-22)32-28-18-14-25(23-8-4-2-5-9-23)20-30(28)33-31-21-26(15-19-29(31)32)24-10-6-3-7-11-24/h2-21H,1H3.
What are the key properties of 10-(4-methylphenyl)-3,7-diphenylphenoxazine?
10-(4-methylphenyl)-3,7-diphenylphenoxazine has a molecular weight of 425.53 g/mol, XLogP of 8.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-methylphenyl)-3,7-diphenylphenoxazine is sourced from PubChem (CID 58556205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).