(Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-phenylacetamide
TL;DR: (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-phenylacetamide (CAS 902017-95-2) is a chemical compound with molecular formula C21H20N2O5S2 and molecular weight 444.08 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-phenylacetamide
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)-2-phenylacetamide, N-[(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide, 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-phenylacetamide
| Molecular Formula | C21H20N2O5S2 |
|---|---|
| Molecular Weight | 444.08 g/mol |
| LogP | 2.3019 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.08136 |
| Heavy Atoms | 30 |
| Complexity | 1117.4716 |
Chemical Identifiers
| CAS Number | 902017-95-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)N3C4CS(=O)(=O)CC4SC3=NC(=O)CC5=CC=CC=C5 |
Product Overview
(Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-phenylacetamide (CAS 902017-95-2), with molecular formula C21H20N2O5S2 and molecular weight 444.08 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-phenylacetamide.
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)-2-phenylacetamide
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)-2-phenylacetamide
The XLogP value of 2.3019 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)-2-phenylacetamide. 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)-2-phenylacetamide. 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)-2-phenylacetamide 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)-2-phenylacetamide?
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)-2-phenylacetamide is 902017-95-2.
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)-2-phenylacetamide?
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)-2-phenylacetamide is C21H20N2O5S2.
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)-2-phenylacetamide?
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)-2-phenylacetamide is 444.08 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)-2-phenylacetamide?
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)-2-phenylacetamide 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)-2-phenylacetamide?
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)-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.