2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine

C23H17N3S — CID 146367883

IUPAC2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine
SMILESCCc1nc(-c2ccccc2)nc(-c2cccc3c2sc2ccccc23)n1
InChIInChI=1S/C23H17N3S/c1-2-20-24-22(15-9-4-3-5-10-15)26-23(25-20)18-13-8-12-17-16-11-6-7-14-19(16)27-21(17)18/h3-14H,2H2,1H3
InChIKeyDMQKEDDVZLYYEG-UHFFFAOYSA-N
MW367.48 g/mol
LogP6.14
Rot. Bonds3

About 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine

2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine (PubChem CID 146367883) has the molecular formula C23H17N3S and a molecular weight of 367.48 g/mol. Its IUPAC name is 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine
PubChem CID146367883
Molecular FormulaC23H17N3S
Molecular Weight367.48 g/mol
Exact Mass367.11
IUPAC Name2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine
SMILESCCc1nc(-c2ccccc2)nc(-c2cccc3c2sc2ccccc23)n1
InChIInChI=1S/C23H17N3S/c1-2-20-24-22(15-9-4-3-5-10-15)26-23(25-20)18-13-8-12-17-16-11-6-7-14-19(16)27-21(17)18/h3-14H,2H2,1H3
InChIKeyDMQKEDDVZLYYEG-UHFFFAOYSA-N
XLogP6.14
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.48
LogP ≤ 56.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine 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

2-dibenzothiophen-4-yl-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 168831660
2-dibenzothiophen-4-yl-4-naphthalen-1-yl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 177112658
2-(9-dibenzothiophen-4-yldibenzothiophen-4-yl)-4,6-diphenyl-1,3,5-triazine
CID 166953027
2-chloro-4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazine
CID 118539812
2-(4-dibenzothiophen-4-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 164737126
2-naphtho[1,2-b][1]benzothiol-4-yl-4,6-diphenyl-1,3,5-triazine
CID 146658673
2-dibenzothiophen-4-yl-4-phenyl-6-[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 155763972
2-dibenzothiophen-4-yl-4-phenyl-6-[4-[2-(4-phenylnaphthalen-1-yl)phenyl]phenyl]-1,3,5-triazine
CID 155481250
2-[4-(1-benzothiophen-2-yl)phenyl]-4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazine
CID 146183517
2-dibenzothiophen-4-yl-4-(4-phenylphenyl)-6-[6-(4-phenylphenyl)naphthalen-2-yl]-1,3,5-triazine
CID 139442046
2-dibenzothiophen-4-yl-4-phenyl-6-[4-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]naphthalen-1-yl]-1,3,5-triazine
CID 139441835
2-dibenzothiophen-4-yl-4-[4-(7-phenylnaphthalen-2-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 139441660

Frequently Asked Questions

What is the IUPAC name of 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine?
The IUPAC name of 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine (CID 146367883) is 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine.
What is the SMILES notation for 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine?
The canonical SMILES for 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine is CCc1nc(-c2ccccc2)nc(-c2cccc3c2sc2ccccc23)n1.
What is the InChIKey of 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine?
The InChIKey is DMQKEDDVZLYYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3S/c1-2-20-24-22(15-9-4-3-5-10-15)26-23(25-20)18-13-8-12-17-16-11-6-7-14-19(16)27-21(17)18/h3-14H,2H2,1H3.
What are the key properties of 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine?
2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine has a molecular weight of 367.48 g/mol, XLogP of 6.14, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzothiophen-4-yl-4-ethyl-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 146367883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).