ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin

C12H18S2Sn2 — CID 140651479

IUPACethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin
SMILESCC[Sn]Cc1cc2sc([Sn](C)(C)C)cc2s1
InChIInChI=1S/C7H4S2.C2H5.3CH3.2Sn/c1-5-4-7-6(9-5)2-3-8-7;1-2;;;;;/h2,4H,1H2;1H2,2H3;3*1H3;;
InChIKeyXWHISWHDOBVGFA-UHFFFAOYSA-N
MW463.83 g/mol
LogP4.15
Rot. Bonds4

About ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin

ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin (PubChem CID 140651479) has the molecular formula C12H18S2Sn2 and a molecular weight of 463.83 g/mol. Its IUPAC name is ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin.

Molecular Properties

Compound Nameethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin
PubChem CID140651479
Molecular FormulaC12H18S2Sn2
Molecular Weight463.83 g/mol
Exact Mass465.89
IUPAC Nameethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin
SMILESCC[Sn]Cc1cc2sc([Sn](C)(C)C)cc2s1
InChIInChI=1S/C7H4S2.C2H5.3CH3.2Sn/c1-5-4-7-6(9-5)2-3-8-7;1-2;;;;;/h2,4H,1H2;1H2,2H3;3*1H3;;
InChIKeyXWHISWHDOBVGFA-UHFFFAOYSA-N
XLogP4.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.83
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl-[(7-trimethylstannyl-[1]benzothiolo[6,5-f][1]benzothiol-2-yl)methyl]tin
CID 140682162
ethyl-[(5-trimethylstannylthiophen-2-yl)methyl]tin
CID 58130831
trimethyl-(2-trimethylstannyl-[1]benzothiolo[5,4-e][1]benzothiol-7-yl)stannane
CID 142287598
ethyl-[[3,3,14,14-tetracyclohexyl-21-(dimethylamino)-10-(methylaminomethyl)-17-trimethylstannyl-7,18-dithiahexacyclo[10.10.0.02,9.04,8.013,20.015,19]docosa-1(22),2(9),4(8),5,10,12,15(19),16,20-nonaen-6-yl]methyl]tin
CID 140721309
2,5-dioctylthieno[3,2-b]thiophene
CID 139270896
2-(aminomethyl)thieno[3,2-b]thiophen-5-ol
CID 82602213
2-methyl-5-propylthieno[3,2-b]thiophene
CID 152905124
(6-chlorothieno[3,2-c]pyridin-2-yl)-trimethylstannane
CID 166146158
5-ethyl-3-iodo-1,2-thiazole
CID 135219656
5-bromo-2-propylthieno[3,2-b]thiophene
CID 150448843
[4,8-bis(5-ethylthiophen-2-yl)-2-trimethylstannylthieno[2,3-f][1]benzothiol-6-yl]-trimethylstannane
CID 177425963
trimethyl-(3-octyl-5-trimethylstannylthiophen-2-yl)stannane
CID 154725648

Frequently Asked Questions

What is the IUPAC name of ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin?
The IUPAC name of ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin (CID 140651479) is ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin.
What is the SMILES notation for ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin?
The canonical SMILES for ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin is CC[Sn]Cc1cc2sc([Sn](C)(C)C)cc2s1.
What is the InChIKey of ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin?
The InChIKey is XWHISWHDOBVGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4S2.C2H5.3CH3.2Sn/c1-5-4-7-6(9-5)2-3-8-7;1-2;;;;;/h2,4H,1H2;1H2,2H3;3*1H3;;.
What are the key properties of ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin?
ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin has a molecular weight of 463.83 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-[(5-trimethylstannylthieno[3,2-b]thiophen-2-yl)methyl]tin is sourced from PubChem (CID 140651479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).