5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole

C37H22N2O — CID 144687418

IUPAC5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole
SMILESC1=CC=Cc2c(c3ccccc3n2-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)C=1
InChIInChI=1S/C37H22N2O/c1-2-10-26-27-11-4-7-15-33(27)38(32(26)14-3-1)24-18-20-36-30(22-24)31-23-25(19-21-37(31)40-36)39-34-16-8-5-12-28(34)29-13-6-9-17-35(29)39/h1,3-23H
InChIKeyQNOCQUVWFAOXMK-UHFFFAOYSA-N
MW510.60 g/mol
LogP9.82
Rot. Bonds2

About 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole

5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole (PubChem CID 144687418) has the molecular formula C37H22N2O and a molecular weight of 510.60 g/mol. Its IUPAC name is 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole.

Molecular Properties

Compound Name5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole
PubChem CID144687418
Molecular FormulaC37H22N2O
Molecular Weight510.60 g/mol
Exact Mass510.17
IUPAC Name5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole
SMILESC1=CC=Cc2c(c3ccccc3n2-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)C=1
InChIInChI=1S/C37H22N2O/c1-2-10-26-27-11-4-7-15-33(27)38(32(26)14-3-1)24-18-20-36-30(22-24)31-23-25(19-21-37(31)40-36)39-34-16-8-5-12-28(34)29-13-6-9-17-35(29)39/h1,3-23H
InChIKeyQNOCQUVWFAOXMK-UHFFFAOYSA-N
XLogP9.82
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.60
LogP ≤ 59.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole with MolForge

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

Launch Full Analysis

Related Compounds

9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole
CID 59348295
9-[16-(16-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-6-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]carbazole
CID 59147197
9-(16-carbazol-9-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole
CID 59147402
9-dibenzofuran-2-yl-3-methylcarbazole
CID 90211137
9-[8-[8-(8-carbazol-9-yldibenzofuran-2-yl)dibenzofuran-2-yl]dibenzofuran-2-yl]carbazole;9-[8-[3-[3-(8-carbazol-9-yldibenzofuran-2-yl)phenyl]phenyl]dibenzofuran-2-yl]carbazole
CID 158645763
CID 168812360
CID 168812360
9-[8-(3-sulfanylcarbazol-9-yl)dibenzofuran-2-yl]carbazole-3-thiol
CID 59445003
9-[16-[2,4,5-tris(16-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-6-yl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]carbazole
CID 59147302
(8-carbazol-9-yldibenzofuran-2-yl)boronic acid
CID 89433899
3-(8-carbazol-9-yldibenzofuran-2-yl)-9-phenylcarbazole
CID 59348276
9-[4-[8-(4-carbazol-9-ylphenyl)dibenzofuran-2-yl]phenyl]carbazole
CID 118148524
9-(17-carbazol-9-yl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole
CID 59147323

Frequently Asked Questions

What is the IUPAC name of 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole?
The IUPAC name of 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole (CID 144687418) is 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole.
What is the SMILES notation for 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole?
The canonical SMILES for 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole is C1=CC=Cc2c(c3ccccc3n2-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)C=1.
What is the InChIKey of 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole?
The InChIKey is QNOCQUVWFAOXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H22N2O/c1-2-10-26-27-11-4-7-15-33(27)38(32(26)14-3-1)24-18-20-36-30(22-24)31-23-25(19-21-37(31)40-36)39-34-16-8-5-12-28(34)29-13-6-9-17-35(29)39/h1,3-23H.
What are the key properties of 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole?
5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole has a molecular weight of 510.60 g/mol, XLogP of 9.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-carbazol-9-yldibenzofuran-2-yl)cyclohepta[b]indole is sourced from PubChem (CID 144687418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).