7-phenyl-3,4-dihydrodibenzothiophene

C18H14S — CID 167310595

IUPAC7-phenyl-3,4-dihydrodibenzothiophene
SMILESC1=Cc2c(sc3cc(-c4ccccc4)ccc23)CC1
InChIInChI=1S/C18H14S/c1-2-6-13(7-3-1)14-10-11-16-15-8-4-5-9-17(15)19-18(16)12-14/h1-4,6-8,10-12H,5,9H2
InChIKeyJHPUGLDENBFOBX-UHFFFAOYSA-N
MW262.38 g/mol
LogP5.53
Rot. Bonds1

About 7-phenyl-3,4-dihydrodibenzothiophene

7-phenyl-3,4-dihydrodibenzothiophene (PubChem CID 167310595) has the molecular formula C18H14S and a molecular weight of 262.38 g/mol. Its IUPAC name is 7-phenyl-3,4-dihydrodibenzothiophene.

Molecular Properties

Compound Name7-phenyl-3,4-dihydrodibenzothiophene
PubChem CID167310595
Molecular FormulaC18H14S
Molecular Weight262.38 g/mol
Exact Mass262.08
IUPAC Name7-phenyl-3,4-dihydrodibenzothiophene
SMILESC1=Cc2c(sc3cc(-c4ccccc4)ccc23)CC1
InChIInChI=1S/C18H14S/c1-2-6-13(7-3-1)14-10-11-16-15-8-4-5-9-17(15)19-18(16)12-14/h1-4,6-8,10-12H,5,9H2
InChIKeyJHPUGLDENBFOBX-UHFFFAOYSA-N
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.38
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[12-(6,7-dihydrodibenzothiophen-3-yl)tetracen-5-yl]dibenzothiophene
CID 89016439
2-[11,17-di(dibenzothiophen-2-yl)-24-(6,7-dihydrodibenzothiophen-2-yl)-4-hexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1,3,5,7,9,11,13,15(20),16,18,21(26),22,24-tridecaenyl]dibenzothiophene
CID 89132816
N,4-bis(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]-6,7-dihydrodibenzothiophen-3-amine
CID 142406033
2-[2-[3-dibenzothiophen-3-yl-5-(6,7-dihydrodibenzothiophen-1-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 170367880
5-(4-phenylphenyl)-10,11-dihydro-[1]benzothiolo[3,2-c]carbazole
CID 144884862
2-phenyl-8-(10-phenyl-3,4-dihydroanthracen-9-yl)dibenzothiophene
CID 155028360
3-tert-butyl-2-[3-(6,7-dihydrodibenzothiophen-2-yl)phenyl]phenanthro[9,10-b]pyrazine
CID 88905839
6-(9-naphthalen-2-ylchrysen-3-yl)-3,4-dihydrodibenzothiophene
CID 123548738
2-(6,7-dihydrodibenzothiophen-3-yl)-4-(9H-fluoren-1-yl)-6-[3-methyl-2-(2-methylphenyl)phenyl]-1,3,5-triazine
CID 170134390
3-[4-(10,11-dihydro-[1]benzothiolo[3,2-c]carbazol-5-yl)phenyl]-N,N-diphenylaniline
CID 163478286
7,8-dihydro-[1]benzothiolo[2,3-b]pyridine
CID 152942948
N-(4-dibenzothiophen-4-ylphenyl)-4-(6,7-dihydrodibenzothiophen-4-yl)-N-[4-(6-phenyldibenzothiophen-4-yl)phenyl]aniline
CID 131994040

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-3,4-dihydrodibenzothiophene?
The IUPAC name of 7-phenyl-3,4-dihydrodibenzothiophene (CID 167310595) is 7-phenyl-3,4-dihydrodibenzothiophene.
What is the SMILES notation for 7-phenyl-3,4-dihydrodibenzothiophene?
The canonical SMILES for 7-phenyl-3,4-dihydrodibenzothiophene is C1=Cc2c(sc3cc(-c4ccccc4)ccc23)CC1.
What is the InChIKey of 7-phenyl-3,4-dihydrodibenzothiophene?
The InChIKey is JHPUGLDENBFOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14S/c1-2-6-13(7-3-1)14-10-11-16-15-8-4-5-9-17(15)19-18(16)12-14/h1-4,6-8,10-12H,5,9H2.
What are the key properties of 7-phenyl-3,4-dihydrodibenzothiophene?
7-phenyl-3,4-dihydrodibenzothiophene has a molecular weight of 262.38 g/mol, XLogP of 5.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-3,4-dihydrodibenzothiophene is sourced from PubChem (CID 167310595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).