2H-thieno[3,2-d]quinoline;hydrobromide

C11H10BrNS — CID 21162133

IUPAC2H-thieno[3,2-d]quinoline;hydrobromide
SMILESBr.C1=CC2=NC=CC3=CCSC32C=C1
InChIInChI=1S/C11H9NS.BrH/c1-2-6-11-9(5-8-13-11)4-7-12-10(11)3-1;/h1-7H,8H2;1H
InChIKeyDCLGITRREGBNTA-UHFFFAOYSA-N
MW268.18 g/mol
LogP3.07
Rot. Bonds

About 2H-thieno[3,2-d]quinoline;hydrobromide

2H-thieno[3,2-d]quinoline;hydrobromide (PubChem CID 21162133) has the molecular formula C11H10BrNS and a molecular weight of 268.18 g/mol. Its IUPAC name is 2H-thieno[3,2-d]quinoline;hydrobromide.

Molecular Properties

Compound Name2H-thieno[3,2-d]quinoline;hydrobromide
PubChem CID21162133
Molecular FormulaC11H10BrNS
Molecular Weight268.18 g/mol
Exact Mass266.97
IUPAC Name2H-thieno[3,2-d]quinoline;hydrobromide
SMILESBr.C1=CC2=NC=CC3=CCSC32C=C1
InChIInChI=1S/C11H9NS.BrH/c1-2-6-11-9(5-8-13-11)4-7-12-10(11)3-1;/h1-7H,8H2;1H
InChIKeyDCLGITRREGBNTA-UHFFFAOYSA-N
XLogP3.07
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.18
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Benzo[b]thieno[2,3-c]pyridine
CID 19960921
Thiopyranoindole
CID 86746699
Thienobenzazepin
CID 88798857
Pyrrolobenzo[d]thiepine
CID 129739582
8-Methylbenzo[b]thieno[2,3-c]-pyridine
CID 129797974
Tetrahydrobenzo[b]thieno[3,2-d]azocine
CID 129871501
2H-[1,3]thiazolo[4,5-d]quinoline
CID 20066503
[1,4]Thiazino[3,2-b]carbazole
CID 21887312
[1,4]Thiazino[2,3-a]carbazole
CID 21888125
10H-thieno[3,2-d]quinoline
CID 53947515
2H-pyrrolo[2,3-i][1,5]benzothiazepine
CID 70122398
2H-thieno[2,3-g][1]benzazepine
CID 140643697

Frequently Asked Questions

What is the IUPAC name of 2H-thieno[3,2-d]quinoline;hydrobromide?
The IUPAC name of 2H-thieno[3,2-d]quinoline;hydrobromide (CID 21162133) is 2H-thieno[3,2-d]quinoline;hydrobromide.
What is the SMILES notation for 2H-thieno[3,2-d]quinoline;hydrobromide?
The canonical SMILES for 2H-thieno[3,2-d]quinoline;hydrobromide is Br.C1=CC2=NC=CC3=CCSC32C=C1.
What is the InChIKey of 2H-thieno[3,2-d]quinoline;hydrobromide?
The InChIKey is DCLGITRREGBNTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NS.BrH/c1-2-6-11-9(5-8-13-11)4-7-12-10(11)3-1;/h1-7H,8H2;1H.
What are the key properties of 2H-thieno[3,2-d]quinoline;hydrobromide?
2H-thieno[3,2-d]quinoline;hydrobromide has a molecular weight of 268.18 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-thieno[3,2-d]quinoline;hydrobromide is sourced from PubChem (CID 21162133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).