10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine

C48H32N2O — CID 134475798

IUPAC10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
SMILESc1ccc(-c2ccc(N3c4ccccc4Oc4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc2)cc1
InChIInChI=1S/C48H32N2O/c1-3-12-33(13-4-1)35-22-26-39(27-23-35)49-45-20-9-10-21-47(45)51-48-32-38(25-29-46(48)49)37-24-28-44-42(31-37)41-18-7-8-19-43(41)50(44)40-17-11-16-36(30-40)34-14-5-2-6-15-34/h1-32H
InChIKeyKCLCKYYXNYRLOZ-UHFFFAOYSA-N
MW652.80 g/mol
LogP13.36
Rot. Bonds5

About 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine

10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine (PubChem CID 134475798) has the molecular formula C48H32N2O and a molecular weight of 652.80 g/mol. Its IUPAC name is 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine.

Molecular Properties

Compound Name10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
PubChem CID134475798
Molecular FormulaC48H32N2O
Molecular Weight652.80 g/mol
Exact Mass652.25
IUPAC Name10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
SMILESc1ccc(-c2ccc(N3c4ccccc4Oc4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc2)cc1
InChIInChI=1S/C48H32N2O/c1-3-12-33(13-4-1)35-22-26-39(27-23-35)49-45-20-9-10-21-47(45)51-48-32-38(25-29-46(48)49)37-24-28-44-42(31-37)41-18-7-8-19-43(41)50(44)40-17-11-16-36(30-40)34-14-5-2-6-15-34/h1-32H
InChIKeyKCLCKYYXNYRLOZ-UHFFFAOYSA-N
XLogP13.36
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500652.80
LogP ≤ 513.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
N,N-diphenyl-4-[3-(10-phenylphenoxazin-3-yl)carbazol-9-yl]aniline
CID 147912487
10-dibenzofuran-4-yl-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134476370
11-[3-phenyl-6-[9-[3-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-9-yl]-8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 129289224
2-phenyl-5-[4-(10-phenylphenoxazin-3-yl)phenyl]phenanthridin-6-one
CID 137401641
7-(4-phenylphenyl)-10-[9-(3-triphenylen-2-ylphenyl)carbazol-3-yl]benzo[c]phenoxazine
CID 155791171
5-[4-(3-carbazol-9-ylphenyl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 164795226
16-[4-(3-phenoxazin-10-ylcarbazol-9-yl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene
CID 164795537
3-[3-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]phenyl]-10-phenylphenoxazine
CID 134475859
5-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaene
CID 164795199
25-(3-phenylphenyl)-21-[9-(3-phenylphenyl)carbazol-3-yl]-2,16-dioxa-9,25-diazaheptacyclo[15.10.1.03,8.09,28.010,15.018,26.019,24]octacosa-1(28),3,5,7,10,12,14,17,19(24),20,22,26-dodecaene
CID 142357461
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-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine?
The IUPAC name of 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine (CID 134475798) is 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine.
What is the SMILES notation for 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine?
The canonical SMILES for 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine is c1ccc(-c2ccc(N3c4ccccc4Oc4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc2)cc1.
What is the InChIKey of 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine?
The InChIKey is KCLCKYYXNYRLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2O/c1-3-12-33(13-4-1)35-22-26-39(27-23-35)49-45-20-9-10-21-47(45)51-48-32-38(25-29-46(48)49)37-24-28-44-42(31-37)41-18-7-8-19-43(41)50(44)40-17-11-16-36(30-40)34-14-5-2-6-15-34/h1-32H.
What are the key properties of 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine?
10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine has a molecular weight of 652.80 g/mol, XLogP of 13.36, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine is sourced from PubChem (CID 134475798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).