10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine

C41H26N4O — CID 58570109

IUPAC10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine
SMILESc1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)cc1
InChIInChI=1S/C41H26N4O/c1-2-13-27(14-3-1)43-32-17-6-4-15-28(32)30-25-26-31-29-16-5-7-18-33(29)45(41(31)40(30)43)39-24-12-23-38(42-39)44-34-19-8-10-21-36(34)46-37-22-11-9-20-35(37)44/h1-26H
InChIKeyBMZOSSHMTUHKOF-UHFFFAOYSA-N
MW590.69 g/mol
LogP10.85
Rot. Bonds3

About 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine

10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine (PubChem CID 58570109) has the molecular formula C41H26N4O and a molecular weight of 590.69 g/mol. Its IUPAC name is 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine.

Molecular Properties

Compound Name10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine
PubChem CID58570109
Molecular FormulaC41H26N4O
Molecular Weight590.69 g/mol
Exact Mass590.21
IUPAC Name10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine
SMILESc1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)cc1
InChIInChI=1S/C41H26N4O/c1-2-13-27(14-3-1)43-32-17-6-4-15-28(32)30-25-26-31-29-16-5-7-18-33(29)45(41(31)40(30)43)39-24-12-23-38(42-39)44-34-19-8-10-21-36(34)46-37-22-11-9-20-35(37)44/h1-26H
InChIKeyBMZOSSHMTUHKOF-UHFFFAOYSA-N
XLogP10.85
TPSA35.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.69
LogP ≤ 510.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine?
The IUPAC name of 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine (CID 58570109) is 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine.
What is the SMILES notation for 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine?
The canonical SMILES for 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine is c1ccc(-n2c3ccccc3c3ccc4c5ccccc5n(-c5cccc(N6c7ccccc7Oc7ccccc76)n5)c4c32)cc1.
What is the InChIKey of 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine?
The InChIKey is BMZOSSHMTUHKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H26N4O/c1-2-13-27(14-3-1)43-32-17-6-4-15-28(32)30-25-26-31-29-16-5-7-18-33(29)45(41(31)40(30)43)39-24-12-23-38(42-39)44-34-19-8-10-21-36(34)46-37-22-11-9-20-35(37)44/h1-26H.
What are the key properties of 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine?
10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine has a molecular weight of 590.69 g/mol, XLogP of 10.85, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[6-(11-phenylindolo[2,3-a]carbazol-12-yl)-2-pyridinyl]phenoxazine is sourced from PubChem (CID 58570109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).