10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole

C30H20N4 — CID 123663832

IUPAC10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6ccncc6)cn5)c4c32)cc1
InChIInChI=1S/C30H20N4/c1-2-6-24(7-3-1)34-27-9-5-4-8-25(27)26-12-10-22-16-19-33(29(22)30(26)34)28-13-11-23(20-32-28)21-14-17-31-18-15-21/h1-20H
InChIKeyZRHIUWYNOJVENX-UHFFFAOYSA-N
MW436.52 g/mol
LogP7.18
Rot. Bonds3

About 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole

10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole (PubChem CID 123663832) has the molecular formula C30H20N4 and a molecular weight of 436.52 g/mol. Its IUPAC name is 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole.

Molecular Properties

Compound Name10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole
PubChem CID123663832
Molecular FormulaC30H20N4
Molecular Weight436.52 g/mol
Exact Mass436.17
IUPAC Name10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6ccncc6)cn5)c4c32)cc1
InChIInChI=1S/C30H20N4/c1-2-6-24(7-3-1)34-27-9-5-4-8-25(27)26-12-10-22-16-19-33(29(22)30(26)34)28-13-11-23(20-32-28)21-14-17-31-18-15-21/h1-20H
InChIKeyZRHIUWYNOJVENX-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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Frequently Asked Questions

What is the IUPAC name of 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole?
The IUPAC name of 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole (CID 123663832) is 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole.
What is the SMILES notation for 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole?
The canonical SMILES for 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole is c1ccc(-n2c3ccccc3c3ccc4ccn(-c5ccc(-c6ccncc6)cn5)c4c32)cc1.
What is the InChIKey of 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole?
The InChIKey is ZRHIUWYNOJVENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N4/c1-2-6-24(7-3-1)34-27-9-5-4-8-25(27)26-12-10-22-16-19-33(29(22)30(26)34)28-13-11-23(20-32-28)21-14-17-31-18-15-21/h1-20H.
What are the key properties of 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole?
10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]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 10-phenyl-1-(5-pyridin-4-yl-2-pyridinyl)pyrrolo[2,3-a]carbazole is sourced from PubChem (CID 123663832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).