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

• ChemBase ID: 190134
• Molecular Formular: C25H18N2
• Molecular Mass: 346.42382
• Monoisotopic Mass: 346.14699859
• SMILES: n1(Cn2c3c(c4c2cccc4)cccc3)c2c(c3c1cccc3)cccc2
• Canonical SMILES: c1ccc2c(c1)n(Cn1c3ccccc3c3c1cccc3)c1c2cccc1
• InChI: InChI=1S/C25H18N2/c1-5-13-22-18(9-1)19-10-2-6-14-23(19)26(22)17-27-24-15-7-3-11-20(24)21-12-4-8-16-25(21)27/h1-16H,17H2
• InChIKey: ZHENGQSAYATKAZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 9-(9H-carbazol-9-ylmethyl)-9H-carbazole
• IUPAC Traditional name: 9-(carbazol-9-ylmethyl)carbazole

Database IDs

• PubChem SID: 164246044
• PubChem CID: 231656

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 6.5676994
• LogD (pH = 7.4): 6.5676994
• Log P: 6.5676994
• Molar Refractivity: 109.5783 cm^3
• Polarizability: 47.66733 Å^3
• Polar Surface Area: 9.86 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Classification: Derivatives & analogs of Natural Compounds