10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine
C184H120N12O4S — CID 158547958
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine
SMILESc1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3ccc4ccccc4c3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3cccc4ccccc34)c3cc(N4c5ccccc5Oc5ccccc54)ccc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Oc5ccccc54)cnc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Sc5ccccc54)ccc3n2)cc1
InChIInChI=1S/C45H29N3O.2C37H24N2O.C33H22N2S.C32H21N3O/c1-3-13-30(14-4-1)35-29-39(31-23-26-41-37(27-31)34-17-7-8-18-40(34)47(41)32-15-5-2-6-16-32)46-38-25-24-33(28-36(35)38)48-42-19-9-11-21-44(42)49-45-22-12-10-20-43(45)48;1-2-12-26(13-3-1)33-24-30(29-16-10-14-25-11-4-5-15-28(25)29)31-23-27(21-22-32(31)38-33)39-34-17-6-8-19-36(34)40-37-20-9-7-18-35(37)39;1-2-11-26(12-3-1)30-24-33(28-19-18-25-10-4-5-13-27(25)22-28)38-32-21-20-29(23-31(30)32)39-34-14-6-8-16-36(34)40-37-17-9-7-15-35(37)39;1-3-11-23(12-4-1)26-22-29(24-13-5-2-6-14-24)34-28-20-19-25(21-27(26)28)35-30-15-7-9-17-32(30)36-33-18-10-8-16-31(33)35;1-3-11-22(12-4-1)25-20-27(23-13-5-2-6-14-23)34-32-26(25)19-24(21-33-32)35-28-15-7-9-17-30(28)36-31-18-10-8-16-29(31)35/h1-29H;2*1-24H;1-22H;1-21H
InChIKeyHPJALCMQTFUZMC-UHFFFAOYSA-N
MW2595.13 g/mol
LogP50.88
Rot. Bonds16
About 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine
10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine (PubChem CID 158547958) has the molecular formula C184H120N12O4S and a molecular weight of 2595.13 g/mol. Its IUPAC name is 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine.
Molecular Properties
| Compound Name | 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine |
|---|---|
| PubChem CID | 158547958 |
| Molecular Formula | C184H120N12O4S |
| Molecular Weight | 2595.13 g/mol |
| Exact Mass | 2592.93 |
| IUPAC Name | 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine |
| SMILES | c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3ccc4ccccc4c3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3cccc4ccccc34)c3cc(N4c5ccccc5Oc5ccccc54)ccc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Oc5ccccc54)cnc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Sc5ccccc54)ccc3n2)cc1 |
| InChI | InChI=1S/C45H29N3O.2C37H24N2O.C33H22N2S.C32H21N3O/c1-3-13-30(14-4-1)35-29-39(31-23-26-41-37(27-31)34-17-7-8-18-40(34)47(41)32-15-5-2-6-16-32)46-38-25-24-33(28-36(35)38)48-42-19-9-11-21-44(42)49-45-22-12-10-20-43(45)48;1-2-12-26(13-3-1)33-24-30(29-16-10-14-25-11-4-5-15-28(25)29)31-23-27(21-22-32(31)38-33)39-34-17-6-8-19-36(34)40-37-20-9-7-18-35(37)39;1-2-11-26(12-3-1)30-24-33(28-19-18-25-10-4-5-13-27(25)22-28)38-32-21-20-29(23-31(30)32)39-34-14-6-8-16-36(34)40-37-17-9-7-15-35(37)39;1-3-11-23(12-4-1)26-22-29(24-13-5-2-6-14-24)34-28-20-19-25(21-27(26)28)35-30-15-7-9-17-32(30)36-33-18-10-8-16-31(33)35;1-3-11-22(12-4-1)25-20-27(23-13-5-2-6-14-23)34-32-26(25)19-24(21-33-32)35-28-15-7-9-17-30(28)36-31-18-10-8-16-29(31)35/h1-29H;2*1-24H;1-22H;1-21H |
| InChIKey | HPJALCMQTFUZMC-UHFFFAOYSA-N |
| XLogP | 50.88 |
| TPSA | 135.39 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 17 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 201 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2595.13 |
| LogP ≤ 5 | 50.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 17 |
Frequently Asked Questions
What is the IUPAC name of 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine?
The IUPAC name of 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine (CID 158547958) is 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine.
What is the SMILES notation for 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine?
The canonical SMILES for 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine is c1ccc(-c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3ccc4ccccc4c3)nc3ccc(N4c5ccccc5Oc5ccccc54)cc23)cc1.c1ccc(-c2cc(-c3cccc4ccccc34)c3cc(N4c5ccccc5Oc5ccccc54)ccc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Oc5ccccc54)cnc3n2)cc1.c1ccc(-c2cc(-c3ccccc3)c3cc(N4c5ccccc5Sc5ccccc54)ccc3n2)cc1.
What is the InChIKey of 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine?
The InChIKey is HPJALCMQTFUZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29N3O.2C37H24N2O.C33H22N2S.C32H21N3O/c1-3-13-30(14-4-1)35-29-39(31-23-26-41-37(27-31)34-17-7-8-18-40(34)47(41)32-15-5-2-6-16-32)46-38-25-24-33(28-36(35)38)48-42-19-9-11-21-44(42)49-45-22-12-10-20-43(45)48;1-2-12-26(13-3-1)33-24-30(29-16-10-14-25-11-4-5-15-28(25)29)31-23-27(21-22-32(31)38-33)39-34-17-6-8-19-36(34)40-37-20-9-7-18-35(37)39;1-2-11-26(12-3-1)30-24-33(28-19-18-25-10-4-5-13-27(25)22-28)38-32-21-20-29(23-31(30)32)39-34-14-6-8-16-36(34)40-37-17-9-7-15-35(37)39;1-3-11-23(12-4-1)26-22-29(24-13-5-2-6-14-24)34-28-20-19-25(21-27(26)28)35-30-15-7-9-17-32(30)36-33-18-10-8-16-31(33)35;1-3-11-22(12-4-1)25-20-27(23-13-5-2-6-14-23)34-32-26(25)19-24(21-33-32)35-28-15-7-9-17-30(28)36-31-18-10-8-16-29(31)35/h1-29H;2*1-24H;1-22H;1-21H.
What are the key properties of 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine?
10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine has a molecular weight of 2595.13 g/mol, XLogP of 50.88, 16 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(5,7-diphenyl-1,8-naphthyridin-3-yl)phenoxazine;10-(2,4-diphenylquinolin-6-yl)phenothiazine;10-(2-naphthalen-2-yl-4-phenylquinolin-6-yl)phenoxazine;10-(4-naphthalen-1-yl-2-phenylquinolin-6-yl)phenoxazine;10-[4-phenyl-2-(9-phenylcarbazol-3-yl)quinolin-6-yl]phenoxazine is sourced from PubChem (CID 158547958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.
Sources
- PubChem CID 158547958 — identifiers, structure, computed properties (public domain)
How this page is built: methodology · editorial policy & corrections.
For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.