(E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide
TL;DR: (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide (CAS 1024808-90-9) is a chemical compound with molecular formula C18H20N2O6S2 and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]oxolane-2-carboxamide
Also Known As: (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide, N-[(2E)-3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]tetrahydrofuran-2-carboxamide, N-[3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]oxolane-2-carboxamide
| Molecular Formula | C18H20N2O6S2 |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 1.1913 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 424.0763 |
| Heavy Atoms | 28 |
| Complexity | 941.3942 |
Chemical Identifiers
| CAS Number | 1024808-90-9 |
|---|---|
| SMILES | C1CC(OC1)C(=O)N=C2N(C3CS(=O)(=O)CC3S2)CC4=CC5=C(C=C4)OCO5 |
Product Overview
(E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide (CAS 1024808-90-9), with molecular formula C18H20N2O6S2 and molecular weight 424.08 g/mol. IUPAC: N-[3-(1,3-benzodioxol-5-ylmethyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]oxolane-2-carboxamide.
Chemical Property Profile of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide
Property Insights of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide
The XLogP value of 1.1913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide. Following Lipinski's Rule of Five, (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide 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 (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide?
The CAS number of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide is 1024808-90-9.
What is the molecular formula of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide?
The molecular formula of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide is C18H20N2O6S2.
What is the molecular weight of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide?
The molecular weight of (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide is 424.08 g/mol.
Where can I buy (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide?
You can request a quote for (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)tetrahydrofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.