10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine

C41H27N3O — CID 59372053

IUPAC10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine
SMILESc1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cncc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)cc1
InChIInChI=1S/C41H27N3O/c1-3-11-36-34(9-1)35-10-2-4-12-37(35)43(36)32-21-17-28(18-22-32)30-25-31(27-42-26-30)29-19-23-33(24-20-29)44-38-13-5-7-15-40(38)45-41-16-8-6-14-39(41)44/h1-27H
InChIKeyNQCJRQZJHJFBJO-UHFFFAOYSA-N
MW577.69 g/mol
LogP11.09
Rot. Bonds4

About 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine

10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine (PubChem CID 59372053) has the molecular formula C41H27N3O and a molecular weight of 577.69 g/mol. Its IUPAC name is 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine.

Molecular Properties

Compound Name10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine
PubChem CID59372053
Molecular FormulaC41H27N3O
Molecular Weight577.69 g/mol
Exact Mass577.22
IUPAC Name10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine
SMILESc1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cncc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)cc1
InChIInChI=1S/C41H27N3O/c1-3-11-36-34(9-1)35-10-2-4-12-37(35)43(36)32-21-17-28(18-22-32)30-25-31(27-42-26-30)29-19-23-33(24-20-29)44-38-13-5-7-15-40(38)45-41-16-8-6-14-39(41)44/h1-27H
InChIKeyNQCJRQZJHJFBJO-UHFFFAOYSA-N
XLogP11.09
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500577.69
LogP ≤ 511.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

10-(4-phenoxazin-10-ylphenyl)-14,21-dioxa-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 118442390
9-[3-carbazol-9-yl-5-(5-carbazol-9-yl-3-pyridinyl)phenyl]carbazole;5-(4-carbazol-9-ylphenyl)-N,N-diphenylpyridin-3-amine;5-(4-carbazol-9-ylphenyl)-N-naphthalen-1-yl-N-phenylpyridin-3-amine;10-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenoxazine
CID 160893113
9-[4-[5-[4-(3-carbazol-9-ylphenyl)phenyl]-3-pyridinyl]phenyl]carbazole
CID 59372061
10-(4-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]phenoxazine
CID 134475798
2-(4-carbazol-9-ylphenyl)-3,10-diphenylimidazo[4,5-b]phenoxazine
CID 90201700
3-methyl-9-phenylcarbazole;9-(4-methylphenyl)carbazole;3-methyl-10-phenylphenoxazine;10-(4-methylphenyl)phenoxazine
CID 163970379
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
9-[4-(5-methyl-3-pyridinyl)phenyl]carbazole
CID 58151158
3-(9-phenylcarbazol-3-yl)-10-(3-phenylphenyl)phenoxazine
CID 134475961
3-[4-(3-phenoxazin-10-ylcarbazol-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 164795331
N,N-diphenyl-4-[3-(10-phenylphenoxazin-3-yl)carbazol-9-yl]aniline
CID 147912487
2-(4-carbazol-9-ylphenyl)-5-phenyl-[1,3]oxazolo[4,5-b]phenoxazine
CID 90201733

Frequently Asked Questions

What is the IUPAC name of 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine?
The IUPAC name of 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine (CID 59372053) is 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine.
What is the SMILES notation for 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine?
The canonical SMILES for 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine is c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cncc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c2)cc1.
What is the InChIKey of 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine?
The InChIKey is NQCJRQZJHJFBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3O/c1-3-11-36-34(9-1)35-10-2-4-12-37(35)43(36)32-21-17-28(18-22-32)30-25-31(27-42-26-30)29-19-23-33(24-20-29)44-38-13-5-7-15-40(38)45-41-16-8-6-14-39(41)44/h1-27H.
What are the key properties of 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine?
10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine has a molecular weight of 577.69 g/mol, XLogP of 11.09, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-[5-(4-carbazol-9-ylphenyl)-3-pyridinyl]phenyl]phenoxazine is sourced from PubChem (CID 59372053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).