2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline

C14H18N2O2S2 — CID 15350040

IUPAC2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline
SMILESCCSc1nc2c(OC)ccc(OC)c2nc1SCC
InChIInChI=1S/C14H18N2O2S2/c1-5-19-13-14(20-6-2)16-12-10(18-4)8-7-9(17-3)11(12)15-13/h7-8H,5-6H2,1-4H3
InChIKeyRMRICQPTHVPACG-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.87
Rot. Bonds6

About 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline

2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline (PubChem CID 15350040) has the molecular formula C14H18N2O2S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline.

Molecular Properties

Compound Name2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline
PubChem CID15350040
Molecular FormulaC14H18N2O2S2
Molecular Weight310.44 g/mol
Exact Mass310.08
IUPAC Name2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline
SMILESCCSc1nc2c(OC)ccc(OC)c2nc1SCC
InChIInChI=1S/C14H18N2O2S2/c1-5-19-13-14(20-6-2)16-12-10(18-4)8-7-9(17-3)11(12)15-13/h7-8H,5-6H2,1-4H3
InChIKeyRMRICQPTHVPACG-UHFFFAOYSA-N
XLogP3.87
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline
CID 10658167
2-ethylsulfanyl-1,3-dimethoxybenzene
CID 12913383
4-ethylsulfanyl-2-methoxy-1-methylbenzene
CID 91876133
(5,8-dimethoxyquinolin-2-yl)methanamine
CID 82241956
5-methoxy-2,3,8-trimethylquinoxaline
CID 121009492
3-ethylsulfanyl-5-methoxypyridazine-4-carbonitrile
CID 163771257
2-ethyl-4,7-dimethoxy-1H-benzimidazole
CID 67341831
2-[4-ethylsulfanyl-7-methoxy-2-(4-propan-2-ylphenyl)benzimidazol-1-yl]ethanol
CID 143079019
5-bromo-4-chloro-2-ethyl-8-methoxyquinazoline
CID 114591397
2-chloro-1-ethylsulfanyl-3-methoxybenzene
CID 91876115
2,5-dibromo-8-methoxyquinoline
CID 102941160
N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-4-ethylsulfanylbenzamide
CID 7590122

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline?
The IUPAC name of 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline (CID 15350040) is 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline.
What is the SMILES notation for 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline?
The canonical SMILES for 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline is CCSc1nc2c(OC)ccc(OC)c2nc1SCC.
What is the InChIKey of 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline?
The InChIKey is RMRICQPTHVPACG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S2/c1-5-19-13-14(20-6-2)16-12-10(18-4)8-7-9(17-3)11(12)15-13/h7-8H,5-6H2,1-4H3.
What are the key properties of 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline?
2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline has a molecular weight of 310.44 g/mol, XLogP of 3.87, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethylsulfanyl)-5,8-dimethoxyquinoxaline is sourced from PubChem (CID 15350040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).