quinoxaline;thiophene

C20H16N4S — CID 175432648

IUPACquinoxaline;thiophene
SMILESc1ccc2nccnc2c1.c1ccc2nccnc2c1.c1ccsc1
InChIInChI=1S/2C8H6N2.C4H4S/c2*1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-5-3-1/h2*1-6H;1-4H
InChIKeyNHPSAIQMLGUQPL-UHFFFAOYSA-N
MW344.44 g/mol
LogP5.01
Rot. Bonds

About quinoxaline;thiophene

quinoxaline;thiophene (PubChem CID 175432648) has the molecular formula C20H16N4S and a molecular weight of 344.44 g/mol. Its IUPAC name is quinoxaline;thiophene.

Molecular Properties

Compound Namequinoxaline;thiophene
PubChem CID175432648
Molecular FormulaC20H16N4S
Molecular Weight344.44 g/mol
Exact Mass344.11
IUPAC Namequinoxaline;thiophene
SMILESc1ccc2nccnc2c1.c1ccc2nccnc2c1.c1ccsc1
InChIInChI=1S/2C8H6N2.C4H4S/c2*1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-5-3-1/h2*1-6H;1-4H
InChIKeyNHPSAIQMLGUQPL-UHFFFAOYSA-N
XLogP5.01
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.44
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-Thienyl)quinoxaline
CID 251141
2-(Phenylsulfanyl)quinoxaline
CID 5100142
3-Phenylsulfanylmethyl-quinoxaline-5,7-diamine
CID 44362450
4-(4-Thiophen-2-ylmethyl-piperazin-1-yl)-pyrrolo[1,2-a]quinoxaline
CID 10712742
N,N-dimethyl-5-[(E)-2-quinoxalin-2-ylethenyl]thiophen-2-amine
CID 168282421
2,3-DI-(2-Thienyl)quinoxaline
CID 4357317
2-Thiophen-3-ylquinoxaline
CID 10560488
2-(5-Bromo-2-thienyl)quinoxaline
CID 2801034
2-(5-Bromothiophen-2-yl)-7-fluoroquinoxaline
CID 2727988
2-(3-Piperidin-1-ylpropylsulfanyl)quinoxaline
CID 76321644
4-Thiophen-3-yl-2-[4-(trifluoromethyl)phenyl]-1,5-naphthyridine
CID 145950672
2-(4-Fluorophenyl)-4-thiophen-3-yl-1,5-naphthyridine
CID 145974823

Frequently Asked Questions

What is the IUPAC name of quinoxaline;thiophene?
The IUPAC name of quinoxaline;thiophene (CID 175432648) is quinoxaline;thiophene.
What is the SMILES notation for quinoxaline;thiophene?
The canonical SMILES for quinoxaline;thiophene is c1ccc2nccnc2c1.c1ccc2nccnc2c1.c1ccsc1.
What is the InChIKey of quinoxaline;thiophene?
The InChIKey is NHPSAIQMLGUQPL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H6N2.C4H4S/c2*1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-5-3-1/h2*1-6H;1-4H.
What are the key properties of quinoxaline;thiophene?
quinoxaline;thiophene has a molecular weight of 344.44 g/mol, XLogP of 5.01, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for quinoxaline;thiophene is sourced from PubChem (CID 175432648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).