4-(carbazol-9-ylmethyl)-9H-carbazole

C25H18N2 — CID 167169330

IUPAC4-(carbazol-9-ylmethyl)-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1cccc(Cn3c4ccccc4c4ccccc43)c12
InChIInChI=1S/C25H18N2/c1-4-12-21-20(11-1)25-17(8-7-13-22(25)26-21)16-27-23-14-5-2-9-18(23)19-10-3-6-15-24(19)27/h1-15,26H,16H2
InChIKeyMYPGCWBJYUYLKV-UHFFFAOYSA-N
MW346.43 g/mol
LogP6.48
Rot. Bonds2

About 4-(carbazol-9-ylmethyl)-9H-carbazole

4-(carbazol-9-ylmethyl)-9H-carbazole (PubChem CID 167169330) has the molecular formula C25H18N2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 4-(carbazol-9-ylmethyl)-9H-carbazole.

Molecular Properties

Compound Name4-(carbazol-9-ylmethyl)-9H-carbazole
PubChem CID167169330
Molecular FormulaC25H18N2
Molecular Weight346.43 g/mol
Exact Mass346.15
IUPAC Name4-(carbazol-9-ylmethyl)-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1cccc(Cn3c4ccccc4c4ccccc43)c12
InChIInChI=1S/C25H18N2/c1-4-12-21-20(11-1)25-17(8-7-13-22(25)26-21)16-27-23-14-5-2-9-18(23)19-10-3-6-15-24(19)27/h1-15,26H,16H2
InChIKeyMYPGCWBJYUYLKV-UHFFFAOYSA-N
XLogP6.48
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.43
LogP ≤ 56.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(carbazol-9-ylmethyl)-9H-carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(carbazol-9-ylmethyl)-9H-carbazole?
The IUPAC name of 4-(carbazol-9-ylmethyl)-9H-carbazole (CID 167169330) is 4-(carbazol-9-ylmethyl)-9H-carbazole.
What is the SMILES notation for 4-(carbazol-9-ylmethyl)-9H-carbazole?
The canonical SMILES for 4-(carbazol-9-ylmethyl)-9H-carbazole is c1ccc2c(c1)[nH]c1cccc(Cn3c4ccccc4c4ccccc43)c12.
What is the InChIKey of 4-(carbazol-9-ylmethyl)-9H-carbazole?
The InChIKey is MYPGCWBJYUYLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2/c1-4-12-21-20(11-1)25-17(8-7-13-22(25)26-21)16-27-23-14-5-2-9-18(23)19-10-3-6-15-24(19)27/h1-15,26H,16H2.
What are the key properties of 4-(carbazol-9-ylmethyl)-9H-carbazole?
4-(carbazol-9-ylmethyl)-9H-carbazole has a molecular weight of 346.43 g/mol, XLogP of 6.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbazol-9-ylmethyl)-9H-carbazole is sourced from PubChem (CID 167169330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).