8-(4-methoxyphenyl)sulfanylquinoline

C16H13NOS — CID 177466194

IUPAC8-(4-methoxyphenyl)sulfanylquinoline
SMILESCOc1ccc(Sc2cccc3cccnc23)cc1
InChIInChI=1S/C16H13NOS/c1-18-13-7-9-14(10-8-13)19-15-6-2-4-12-5-3-11-17-16(12)15/h2-11H,1H3
InChIKeyADTDHFXPXQOQEV-UHFFFAOYSA-N
MW267.35 g/mol
LogP4.39
Rot. Bonds3

About 8-(4-methoxyphenyl)sulfanylquinoline

8-(4-methoxyphenyl)sulfanylquinoline (PubChem CID 177466194) has the molecular formula C16H13NOS and a molecular weight of 267.35 g/mol. Its IUPAC name is 8-(4-methoxyphenyl)sulfanylquinoline.

Molecular Properties

Compound Name8-(4-methoxyphenyl)sulfanylquinoline
PubChem CID177466194
Molecular FormulaC16H13NOS
Molecular Weight267.35 g/mol
Exact Mass267.07
IUPAC Name8-(4-methoxyphenyl)sulfanylquinoline
SMILESCOc1ccc(Sc2cccc3cccnc23)cc1
InChIInChI=1S/C16H13NOS/c1-18-13-7-9-14(10-8-13)19-15-6-2-4-12-5-3-11-17-16(12)15/h2-11H,1H3
InChIKeyADTDHFXPXQOQEV-UHFFFAOYSA-N
XLogP4.39
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-4-quinolin-8-ylsulfanylaniline
CID 177461808
2-(4-methoxyphenyl)sulfanyl-6-methyl-N-quinolin-8-ylbenzamide
CID 122220942
1-methoxy-4-(2-methylsulfanylphenyl)sulfanylbenzene
CID 132916371
1-methoxy-4-(2-methylphenyl)sulfanylbenzene
CID 58715666
4-methoxy-N-(4-oxo-3-quinolin-8-ylsulfanylnaphthalen-1-ylidene)benzenesulfonamide
CID 40862397
1-[2-(4-methoxyphenyl)sulfanyl-3-pyridinyl]ethanol
CID 114057131
N-[1-(4-methoxyphenyl)ethyl]quinolin-8-amine
CID 43191660
[(4-methoxyphenyl)-quinolin-8-ylmethyl]hydrazine
CID 105190768
N-[(4-methoxyphenyl)methyl]-5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-amine
CID 23494750
4-methoxy-N-[(5-quinolin-8-ylsulfanylfuran-2-yl)methylideneamino]benzamide
CID 1247126
4-(2-methoxyphenoxy)-6-quinolin-8-ylsulfanylpyrimidin-5-amine
CID 19154386
5,8-bis[(4-methoxyphenyl)sulfanyl]-N-methylquinoxalin-2-amine
CID 71186469

Frequently Asked Questions

What is the IUPAC name of 8-(4-methoxyphenyl)sulfanylquinoline?
The IUPAC name of 8-(4-methoxyphenyl)sulfanylquinoline (CID 177466194) is 8-(4-methoxyphenyl)sulfanylquinoline.
What is the SMILES notation for 8-(4-methoxyphenyl)sulfanylquinoline?
The canonical SMILES for 8-(4-methoxyphenyl)sulfanylquinoline is COc1ccc(Sc2cccc3cccnc23)cc1.
What is the InChIKey of 8-(4-methoxyphenyl)sulfanylquinoline?
The InChIKey is ADTDHFXPXQOQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NOS/c1-18-13-7-9-14(10-8-13)19-15-6-2-4-12-5-3-11-17-16(12)15/h2-11H,1H3.
What are the key properties of 8-(4-methoxyphenyl)sulfanylquinoline?
8-(4-methoxyphenyl)sulfanylquinoline has a molecular weight of 267.35 g/mol, XLogP of 4.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methoxyphenyl)sulfanylquinoline is sourced from PubChem (CID 177466194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).