2-phenoxy-1-phenylsulfanylnaphthalene

C22H16OS — CID 134956285

IUPAC2-phenoxy-1-phenylsulfanylnaphthalene
SMILESc1ccc(Oc2ccc3ccccc3c2Sc2ccccc2)cc1
InChIInChI=1S/C22H16OS/c1-3-10-18(11-4-1)23-21-16-15-17-9-7-8-14-20(17)22(21)24-19-12-5-2-6-13-19/h1-16H
InChIKeyWDFTUWZRBRFIAI-UHFFFAOYSA-N
MW328.44 g/mol
LogP6.78
Rot. Bonds4

About 2-phenoxy-1-phenylsulfanylnaphthalene

2-phenoxy-1-phenylsulfanylnaphthalene (PubChem CID 134956285) has the molecular formula C22H16OS and a molecular weight of 328.44 g/mol. Its IUPAC name is 2-phenoxy-1-phenylsulfanylnaphthalene.

Molecular Properties

Compound Name2-phenoxy-1-phenylsulfanylnaphthalene
PubChem CID134956285
Molecular FormulaC22H16OS
Molecular Weight328.44 g/mol
Exact Mass328.09
IUPAC Name2-phenoxy-1-phenylsulfanylnaphthalene
SMILESc1ccc(Oc2ccc3ccccc3c2Sc2ccccc2)cc1
InChIInChI=1S/C22H16OS/c1-3-10-18(11-4-1)23-21-16-15-17-9-7-8-14-20(17)22(21)24-19-12-5-2-6-13-19/h1-16H
InChIKeyWDFTUWZRBRFIAI-UHFFFAOYSA-N
XLogP6.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.44
LogP ≤ 56.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(bromomethyl)-2-phenoxynaphthalene
CID 142635993
N-phenyl-1-phenylsulfanylnaphthalen-2-amine
CID 132556912
1-[(2-phenoxynaphthalen-1-yl)diazenyl]naphthalen-2-ol
CID 135514019
2-naphthalen-1-yloxy-1-(2-naphthalen-1-yloxynaphthalen-1-yl)naphthalene
CID 58689928
bis(carbonochloridic acid);4-[1-[2-(4-carbonochloridoylphenoxy)naphthalen-1-yl]naphthalen-2-yl]oxybenzoyl chloride
CID 23064662
1,3,5-trimethoxy-2,4-bis(phenylsulfanyl)benzene
CID 138976814
1-phenoxynaphthalen-2-ol
CID 5271325
1-phenylsulfanylphenanthrene
CID 172559592
potassium phenoxybenzene
CID 19858586
2-phenyl-1-(2-phenylnaphthalen-1-yl)sulfanylnaphthalene
CID 68507510
[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane
CID 20820418
2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
CID 11017918

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-1-phenylsulfanylnaphthalene?
The IUPAC name of 2-phenoxy-1-phenylsulfanylnaphthalene (CID 134956285) is 2-phenoxy-1-phenylsulfanylnaphthalene.
What is the SMILES notation for 2-phenoxy-1-phenylsulfanylnaphthalene?
The canonical SMILES for 2-phenoxy-1-phenylsulfanylnaphthalene is c1ccc(Oc2ccc3ccccc3c2Sc2ccccc2)cc1.
What is the InChIKey of 2-phenoxy-1-phenylsulfanylnaphthalene?
The InChIKey is WDFTUWZRBRFIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16OS/c1-3-10-18(11-4-1)23-21-16-15-17-9-7-8-14-20(17)22(21)24-19-12-5-2-6-13-19/h1-16H.
What are the key properties of 2-phenoxy-1-phenylsulfanylnaphthalene?
2-phenoxy-1-phenylsulfanylnaphthalene has a molecular weight of 328.44 g/mol, XLogP of 6.78, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-1-phenylsulfanylnaphthalene is sourced from PubChem (CID 134956285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).