![(Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide structure](/static/products/902/902009-35-2.png)
(Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide
TL;DR: (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide (CAS 902009-35-2) is a chemical compound with molecular formula C16H16FN3O3S2 and molecular weight 381.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyano-N-[3-[2-(4-fluorophenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]acetamide
Also Known As: (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide, 2-cyano-N-[(2Z)-3-[2-(4-fluorophenyl)ethyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]acetamide, 2-cyano-N-[3-[2-(4-fluorophenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]acetamide, 4-{1-[2-(4-fluorophenyl)ethyl]-5,5-dioxo(1,3,4,6,3a,6a-hexahydro-3,5-dithia-1- azapentalen-2-ylidene)}-3-oxo-4-azabutanenitrile
| Molecular Formula | C16H16FN3O3S2 |
|---|---|
| Molecular Weight | 381.06 g/mol |
| LogP | 1.37888 |
| Topological Polar Surface Area | 90.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.0617 |
| Heavy Atoms | 25 |
| Complexity | 846.3711 |
Chemical Identifiers
| CAS Number | 902009-35-2 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)SC(=NC(=O)CC#N)N2CCC3=CC=C(C=C3)F |
Product Overview
(Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide (CAS 902009-35-2), with molecular formula C16H16FN3O3S2 and molecular weight 381.06 g/mol. IUPAC: 2-cyano-N-[3-[2-(4-fluorophenyl)ethyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]acetamide.
Chemical Property Profile of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide
Property Insights of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide
The XLogP value of 1.37888 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide. The TPSA of 90.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide. Following Lipinski's Rule of Five, (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide has 0 hydrogen bond donor(s) and 5 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)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide?
The CAS number of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide is 902009-35-2.
What is the molecular formula of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide?
The molecular formula of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide is C16H16FN3O3S2.
What is the molecular weight of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide?
The molecular weight of (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide is 381.06 g/mol.
Where can I buy (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide?
You can request a quote for (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-cyano-N-(3-(4-fluorophenethyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.