(Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide
TL;DR: (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide (CAS 900261-58-7) is a chemical compound with molecular formula C18H16N2O5S3 and molecular weight 436.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzodioxol-5-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-thiophen-2-ylacetamide
Also Known As: (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide, N-[(2E)-3-(1,3-benzodioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-(thiophen-2-yl)acetamide, N-[3-(1,3-benzodioxol-5-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-thiophen-2-ylacetamide
| Molecular Formula | C18H16N2O5S3 |
|---|---|
| Molecular Weight | 436.02 g/mol |
| LogP | 2.3209 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.02213 |
| Heavy Atoms | 28 |
| Complexity | 1064.8951 |
Chemical Identifiers
| CAS Number | 900261-58-7 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)SC(=NC(=O)CC3=CC=CS3)N2C4=CC5=C(C=C4)OCO5 |
Product Overview
(Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide (CAS 900261-58-7), with molecular formula C18H16N2O5S3 and molecular weight 436.02 g/mol. IUPAC: N-[3-(1,3-benzodioxol-5-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-thiophen-2-ylacetamide.
Chemical Property Profile of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide
Property Insights of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide
The XLogP value of 2.3209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide. The TPSA of 85.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide. Following Lipinski's Rule of Five, (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide?
The CAS number of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide is 900261-58-7.
What is the molecular formula of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide?
The molecular formula of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide is C18H16N2O5S3.
What is the molecular weight of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide?
The molecular weight of (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide is 436.02 g/mol.
Where can I buy (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide?
You can request a quote for (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-(benzo[d][1,3]dioxol-5-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-(thiophen-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.