10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine

C38H25N5O — CID 140731061

IUPAC10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine
SMILESc1ccc(-c2ccc3c(c2)N(c2cccc(-n4cc(-n5c6ccccc6c6ccccc65)cn4)c2)c2ccccc2O3)nc1
InChIInChI=1S/C38H25N5O/c1-3-15-33-30(12-1)31-13-2-4-16-34(31)43(33)29-24-40-41(25-29)27-10-9-11-28(23-27)42-35-17-5-6-18-37(35)44-38-20-19-26(22-36(38)42)32-14-7-8-21-39-32/h1-25H
InChIKeyXUNDBIQMPBJBJD-UHFFFAOYSA-N
MW567.65 g/mol
LogP9.61
Rot. Bonds4

About 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine

10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine (PubChem CID 140731061) has the molecular formula C38H25N5O and a molecular weight of 567.65 g/mol. Its IUPAC name is 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine.

Molecular Properties

Compound Name10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine
PubChem CID140731061
Molecular FormulaC38H25N5O
Molecular Weight567.65 g/mol
Exact Mass567.21
IUPAC Name10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine
SMILESc1ccc(-c2ccc3c(c2)N(c2cccc(-n4cc(-n5c6ccccc6c6ccccc65)cn4)c2)c2ccccc2O3)nc1
InChIInChI=1S/C38H25N5O/c1-3-15-33-30(12-1)31-13-2-4-16-34(31)43(33)29-24-40-41(25-29)27-10-9-11-28(23-27)42-35-17-5-6-18-37(35)44-38-20-19-26(22-36(38)42)32-14-7-8-21-39-32/h1-25H
InChIKeyXUNDBIQMPBJBJD-UHFFFAOYSA-N
XLogP9.61
TPSA48.11 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500567.65
LogP ≤ 59.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyrrol-1-ylphenoxazine
CID 153492594
10-[1-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]pyrazol-4-yl]phenoxazine
CID 140730449
10-[3-(4-carbazol-9-ylpyrazol-1-yl)benzene-2-id-1-yl]-2-pyrazol-1-yl-1H-phenoxazin-1-ide;10-[3-(4-carbazol-9-ylpyrazol-1-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-phenoxazin-1-ide;2-(4-carbazol-9-ylpyrazol-1-yl)-10-(3-pyrazol-1-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-ide;tris(platinum(2+))
CID 159260208
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole
CID 71277989
9-(3-carbazol-9-ylphenyl)-3-pyridin-2-ylpyrido[3,4-b]indole
CID 139574913
9-(3-carbazol-9-ylphenyl)-3-(3-pyridin-2-ylphenyl)carbazole;ethane
CID 144541414
10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine
CID 59372053
2-[1-(3-pyridin-2-ylphenyl)pyrazol-4-yl]pyridine
CID 11150679
9-phenyl-3-[3-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]carbazole
CID 153423283
9-(3-indazol-1-ylphenyl)-2-pyridin-2-ylcarbazole
CID 140730801
3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
2,8-di(carbazol-9-yl)-10-phenylphenoxazine
CID 126612244

Frequently Asked Questions

What is the IUPAC name of 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine?
The IUPAC name of 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine (CID 140731061) is 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine.
What is the SMILES notation for 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine?
The canonical SMILES for 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine is c1ccc(-c2ccc3c(c2)N(c2cccc(-n4cc(-n5c6ccccc6c6ccccc65)cn4)c2)c2ccccc2O3)nc1.
What is the InChIKey of 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine?
The InChIKey is XUNDBIQMPBJBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25N5O/c1-3-15-33-30(12-1)31-13-2-4-16-34(31)43(33)29-24-40-41(25-29)27-10-9-11-28(23-27)42-35-17-5-6-18-37(35)44-38-20-19-26(22-36(38)42)32-14-7-8-21-39-32/h1-25H.
What are the key properties of 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine?
10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine has a molecular weight of 567.65 g/mol, XLogP of 9.61, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(4-carbazol-9-ylpyrazol-1-yl)phenyl]-2-pyridin-2-ylphenoxazine is sourced from PubChem (CID 140731061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).