(Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide
TL;DR: (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide (CAS 877784-31-1) is a chemical compound with molecular formula C15H17ClN2O3S2 and molecular weight 372.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(3-chloro-2-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide
Also Known As: (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide, N-[(2Z)-3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide, N-[3-(3-chloro-2-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide
| Molecular Formula | C15H17ClN2O3S2 |
|---|---|
| Molecular Weight | 372.04 g/mol |
| LogP | 2.65982 |
| Topological Polar Surface Area | 66.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.03693 |
| Heavy Atoms | 23 |
| Complexity | 791.91174 |
Chemical Identifiers
| CAS Number | 877784-31-1 |
|---|---|
| SMILES | CCC(=O)N=C1N(C2CS(=O)(=O)CC2S1)C3=C(C(=CC=C3)Cl)C |
Product Overview
(Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide (CAS 877784-31-1), with molecular formula C15H17ClN2O3S2 and molecular weight 372.04 g/mol. IUPAC: N-[3-(3-chloro-2-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide.
Chemical Property Profile of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide
Property Insights of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide
The XLogP value of 2.65982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide. The TPSA of 66.81 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide. Following Lipinski's Rule of Five, (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide has 0 hydrogen bond donor(s) and 4 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-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide?
The CAS number of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide is 877784-31-1.
What is the molecular formula of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide?
The molecular formula of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide is C15H17ClN2O3S2.
What is the molecular weight of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide?
The molecular weight of (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide is 372.04 g/mol.
Where can I buy (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide?
You can request a quote for (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide 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-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-(3-chloro-2-methylphenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.