2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole

C32H20N4S — CID 118300806

IUPAC2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole
SMILESc1ccc(-c2ncc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccnc6)c5cc43)s2)cc1
InChIInChI=1S/C32H20N4S/c1-2-9-21(10-3-1)32-34-20-31(37-32)36-28-15-7-5-13-24(28)26-17-25-23-12-4-6-14-27(23)35(29(25)18-30(26)36)22-11-8-16-33-19-22/h1-20H
InChIKeyWQOHVDIJRDGMEM-UHFFFAOYSA-N
MW492.61 g/mol
LogP8.40
Rot. Bonds3

About 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole

2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole (PubChem CID 118300806) has the molecular formula C32H20N4S and a molecular weight of 492.61 g/mol. Its IUPAC name is 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole
PubChem CID118300806
Molecular FormulaC32H20N4S
Molecular Weight492.61 g/mol
Exact Mass492.14
IUPAC Name2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole
SMILESc1ccc(-c2ncc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccnc6)c5cc43)s2)cc1
InChIInChI=1S/C32H20N4S/c1-2-9-21(10-3-1)32-34-20-31(37-32)36-28-15-7-5-13-24(28)26-17-25-23-12-4-6-14-27(23)35(29(25)18-30(26)36)22-11-8-16-33-19-22/h1-20H
InChIKeyWQOHVDIJRDGMEM-UHFFFAOYSA-N
XLogP8.40
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500492.61
LogP ≤ 58.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-5-(14-pyridin-4-yl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)-1,3-thiazole;2-phenyl-5-(11-pyridin-4-ylindolo[2,3-a]carbazol-12-yl)-1,3-thiazole;2-phenyl-5-(7-pyridin-4-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole
CID 158030519
2-phenyl-5-(2,8,11-triphenylindolo[3,2-b]carbazol-5-yl)-1,3-thiazole
CID 118300821
5-[3-(4-phenylphenyl)phenyl]-11-pyridin-3-ylindolo[3,2-b]carbazole
CID 140944253
10-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaene
CID 139575264
5-pyridin-3-ylbenzo[b]carbazole
CID 122464099
26-(3-pyridin-3-ylphenyl)-2,26-diazaheptacyclo[15.11.0.02,10.03,8.011,16.019,27.020,25]octacosa-1(28),3,5,7,9,11,13,15,17,19(27),20,22,24-tridecaene
CID 90432851
2-(4-carbazol-9-ylphenyl)-5-(5-phenylindolo[3,2-b]carbazol-11-yl)-1,3-thiazole;2-(3-carbazol-9-ylphenyl)-5-(5-phenylindolo[3,2-c]carbazol-12-yl)-1,3-thiazole;2-(3-carbazol-9-ylphenyl)-5-(12-phenylindolo[3,2-c]carbazol-5-yl)-1,3-thiazole
CID 162230367
5-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)-2-(3-pyrimidin-2-ylphenyl)-1,3-thiazole
CID 118300889
3-iodo-9-pyridin-3-ylcarbazole
CID 156633056
6-[4-(9-phenylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)pyrido[3,4-b]indole
CID 90336700
3,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-3-ylphenyl)carbazole
CID 160711176
7-(4-phenylphenyl)-5-(9-phenylpyrido[2,3-b]indol-6-yl)indolo[2,3-b]carbazole;7-phenyl-5-(3-pyrido[3,4-b]indol-9-ylphenyl)indolo[2,3-b]carbazole;7-phenyl-5-(4-pyrido[3,4-b]indol-9-ylphenyl)indolo[2,3-b]carbazole;7-phenyl-5-[3-(3-pyrido[3,4-b]indol-9-ylphenyl)phenyl]indolo[2,3-b]carbazole
CID 159693761

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole?
The IUPAC name of 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole (CID 118300806) is 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole.
What is the SMILES notation for 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole?
The canonical SMILES for 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole is c1ccc(-c2ncc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccnc6)c5cc43)s2)cc1.
What is the InChIKey of 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole?
The InChIKey is WQOHVDIJRDGMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N4S/c1-2-9-21(10-3-1)32-34-20-31(37-32)36-28-15-7-5-13-24(28)26-17-25-23-12-4-6-14-27(23)35(29(25)18-30(26)36)22-11-8-16-33-19-22/h1-20H.
What are the key properties of 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole?
2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole has a molecular weight of 492.61 g/mol, XLogP of 8.40, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-(7-pyridin-3-ylindolo[2,3-b]carbazol-5-yl)-1,3-thiazole is sourced from PubChem (CID 118300806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).