10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole

C32H20N2S — CID 123800166

IUPAC10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccc6ccsc6c54)ccc32)cc1
InChIInChI=1S/C32H20N2S/c1-2-8-22(9-3-1)33-28-12-6-5-11-25(28)27-20-23(15-17-30(27)33)34-29-13-7-4-10-24(29)26-16-14-21-18-19-35-32(21)31(26)34/h1-20H
InChIKeyBHHZDSPOUCLLLT-UHFFFAOYSA-N
MW464.59 g/mol
LogP9.10
Rot. Bonds2

About 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole

10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole (PubChem CID 123800166) has the molecular formula C32H20N2S and a molecular weight of 464.59 g/mol. Its IUPAC name is 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole.

Molecular Properties

Compound Name10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole
PubChem CID123800166
Molecular FormulaC32H20N2S
Molecular Weight464.59 g/mol
Exact Mass464.13
IUPAC Name10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccc6ccsc6c54)ccc32)cc1
InChIInChI=1S/C32H20N2S/c1-2-8-22(9-3-1)33-28-12-6-5-11-25(28)27-20-23(15-17-30(27)33)34-29-13-7-4-10-24(29)26-16-14-21-18-19-35-32(21)31(26)34/h1-20H
InChIKeyBHHZDSPOUCLLLT-UHFFFAOYSA-N
XLogP9.10
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.59
LogP ≤ 59.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole 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

3,8-di(carbazol-9-yl)-12-phenyl-[1]benzothiolo[2,3-a]carbazole
CID 67952823
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
12-phenyl-15-(9-phenylcarbazol-3-yl)-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene
CID 122465510
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440
3-carbazol-9-yl-9-phenylcarbazole;ethane
CID 145117169
7-carbazol-9-yl-23-phenyl-3-thia-23-azahexacyclo[11.11.0.02,10.04,9.016,24.017,22]tetracosa-1(13),2(10),4(9),5,7,11,14,16(24),17,19,21-undecaene
CID 118545733
12-phenyl-18-[4-(9-phenylcarbazol-3-yl)phenyl]-15-thia-12,18-diazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.019,24]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),19,21,23,26-dodecaene
CID 121286512
5-carbazol-9-yl-25-(4-carbazol-9-ylphenyl)-1,18,25-triazaoctacyclo[16.13.2.02,7.08,32.011,33.012,17.019,24.026,31]tritriaconta-2(7),3,5,8(32),9,11(33),12,14,16,19,21,23,26,28,30-pentadecaene;5,14-di(carbazol-9-yl)-25-(4-carbazol-9-ylphenyl)-1,18,25-triazaoctacyclo[16.13.2.02,7.08,32.011,33.012,17.019,24.026,31]tritriaconta-2(7),3,5,8(32),9,11(33),12(17),13,15,19,21,23,26,28,30-pentadecaene;5,14-di(carbazol-9-yl)-25-phenyl-1,18,25-triazaoctacyclo[16.13.2.02,7.08,32.011,33.012,17.019,24.026,31]tritriaconta-2(7),3,5,8(32),9,11(33),12(17),13,15,19,21,23,26,28,30-pentadecaene
CID 163886824
9-(9-phenylcarbazol-3-yl)-24-thia-9-azahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18,20,22-undecaene
CID 118503172
12-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-[1]benzothiolo[2,3-a]carbazole
CID 90050986
2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
CID 118504684
12-(6-carbazol-9-ylnaphthalen-2-yl)-[1]benzothiolo[2,3-a]carbazole
CID 167193290

Frequently Asked Questions

What is the IUPAC name of 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole?
The IUPAC name of 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole (CID 123800166) is 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole.
What is the SMILES notation for 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole?
The canonical SMILES for 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole is c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccc6ccsc6c54)ccc32)cc1.
What is the InChIKey of 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole?
The InChIKey is BHHZDSPOUCLLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N2S/c1-2-8-22(9-3-1)33-28-12-6-5-11-25(28)27-20-23(15-17-30(27)33)34-29-13-7-4-10-24(29)26-16-14-21-18-19-35-32(21)31(26)34/h1-20H.
What are the key properties of 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole?
10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole has a molecular weight of 464.59 g/mol, XLogP of 9.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(9-phenylcarbazol-3-yl)thieno[2,3-a]carbazole is sourced from PubChem (CID 123800166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).