![(Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide structure](/static/products/896/896848-70-7.png)
(Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide
TL;DR: (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide (CAS 896848-70-7) is a chemical compound with molecular formula C17H20N2O5S2 and molecular weight 396.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide
Also Known As: (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide, N-[(2Z)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-methylpropanamide, N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide
| Molecular Formula | C17H20N2O5S2 |
|---|---|
| Molecular Weight | 396.08 g/mol |
| LogP | 1.7152 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.08136 |
| Heavy Atoms | 26 |
| Complexity | 881.13947 |
Chemical Identifiers
| CAS Number | 896848-70-7 |
|---|---|
| SMILES | CC(C)C(=O)N=C1N(C2CS(=O)(=O)CC2S1)C3=CC4=C(C=C3)OCCO4 |
Product Overview
(Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide (CAS 896848-70-7), with molecular formula C17H20N2O5S2 and molecular weight 396.08 g/mol. IUPAC: N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-methylpropanamide.
Chemical Property Profile of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide
Property Insights of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide
The XLogP value of 1.7152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide. The TPSA of 85.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide. Following Lipinski's Rule of Five, (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide has 0 hydrogen bond donor(s) and 6 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-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide?
The CAS number of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide is 896848-70-7.
What is the molecular formula of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide?
The molecular formula of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide is C17H20N2O5S2.
What is the molecular weight of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide?
The molecular weight of (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide is 396.08 g/mol.
Where can I buy (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide?
You can request a quote for (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide 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-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)isobutyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.