6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole

C30H20N4 — CID 123906057

IUPAC6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-c2ncc(-n3ccc4c5c6ccccc6n(-c6ccccc6)c5ccc43)cn2)cc1
InChIInChI=1S/C30H20N4/c1-3-9-21(10-4-1)30-31-19-23(20-32-30)33-18-17-25-26(33)15-16-28-29(25)24-13-7-8-14-27(24)34(28)22-11-5-2-6-12-22/h1-20H
InChIKeyUXYDLFYXBSGDPA-UHFFFAOYSA-N
MW436.52 g/mol
LogP7.18
Rot. Bonds3

About 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole

6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole (PubChem CID 123906057) has the molecular formula C30H20N4 and a molecular weight of 436.52 g/mol. Its IUPAC name is 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole.

Molecular Properties

Compound Name6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole
PubChem CID123906057
Molecular FormulaC30H20N4
Molecular Weight436.52 g/mol
Exact Mass436.17
IUPAC Name6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-c2ncc(-n3ccc4c5c6ccccc6n(-c6ccccc6)c5ccc43)cn2)cc1
InChIInChI=1S/C30H20N4/c1-3-9-21(10-4-1)30-31-19-23(20-32-30)33-18-17-25-26(33)15-16-28-29(25)24-13-7-8-14-27(24)34(28)22-11-5-2-6-12-22/h1-20H
InChIKeyUXYDLFYXBSGDPA-UHFFFAOYSA-N
XLogP7.18
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.52
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

17-phenyl-9-[4-(5-phenylpyrimidin-2-yl)phenyl]-9,17-diazapentacyclo[11.7.0.02,10.03,8.014,18]icosa-1(13),2(10),3,5,7,11,14(18),15,19-nonaene
CID 90223464
6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole
CID 90130563
7-phenyl-14-(2-phenylpyrimidin-5-yl)-7,14-diazapentacyclo[11.7.0.03,11.04,8.015,20]icosa-1(13),2,4(8),5,9,11,15,17,19-nonaene
CID 90223580
3-phenyl-6-[3-(3-phenylpyrrolo[2,3-c]carbazol-6-yl)-5-(1,3,5-triazin-2-yl)phenyl]pyrrolo[2,3-c]carbazole
CID 90091085
6-phenyl-1-(2-pyridin-3-ylpyrimidin-5-yl)pyrrolo[3,2-c]carbazole
CID 123895794
17-phenyl-9-(2-phenylpyrimidin-4-yl)-9,17-diazapentacyclo[11.7.0.02,10.03,8.014,18]icosa-1(13),2(10),3,5,7,11,14(18),15,19-nonaene
CID 90223450
6-(2,6-dipyridin-2-yl-4-pyridinyl)-3-(2-pyridin-4-ylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole
CID 123202086
3-phenyl-6-[4-(2-phenylcarbazol-9-yl)phenyl]pyrrolo[2,3-c]carbazole
CID 118315311
23-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,18-diphenyl-9,18,23-triazahexacyclo[11.10.0.02,10.03,8.014,22.017,21]tricosa-1(13),2(10),3,5,7,11,14(22),15,17(21),19-decaene
CID 90267290
3-(4-isoquinolin-4-ylphenyl)-6-phenylpyrrolo[2,3-c]carbazole
CID 123386659
3-phenyl-6-(3-triphenylen-2-ylphenyl)pyrrolo[2,3-c]carbazole
CID 118315256
6-[4-[4-(4,6-diphenyl-2-pyridinyl)quinazolin-2-yl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole
CID 118317331

Frequently Asked Questions

What is the IUPAC name of 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole?
The IUPAC name of 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole (CID 123906057) is 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole.
What is the SMILES notation for 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole?
The canonical SMILES for 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole is c1ccc(-c2ncc(-n3ccc4c5c6ccccc6n(-c6ccccc6)c5ccc43)cn2)cc1.
What is the InChIKey of 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole?
The InChIKey is UXYDLFYXBSGDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N4/c1-3-9-21(10-4-1)30-31-19-23(20-32-30)33-18-17-25-26(33)15-16-28-29(25)24-13-7-8-14-27(24)34(28)22-11-5-2-6-12-22/h1-20H.
What are the key properties of 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole?
6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole has a molecular weight of 436.52 g/mol, XLogP of 7.18, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyl-3-(2-phenylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole is sourced from PubChem (CID 123906057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).