![(E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide structure](/static/products/3134/313404-84-1.webp)
(E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide
TL;DR: (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide (CAS 313404-84-1) is a chemical compound with molecular formula C12H14N2OS and molecular weight 234.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)propanamide
Also Known As: IFLab1_000715, (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide, N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)propanamide, F0214-0234, N-[(2E)-3,6-dimethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanamide
| Molecular Formula | C12H14N2OS |
|---|---|
| Molecular Weight | 234.08 g/mol |
| LogP | 2.38552 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.08269 |
| Heavy Atoms | 16 |
| Complexity | 606.9966 |
Chemical Identifiers
| CAS Number | 313404-84-1 |
|---|---|
| SMILES | CCC(=O)N=C1N(C2=C(S1)C=C(C=C2)C)C |
Product Overview
(E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide (CAS 313404-84-1), with molecular formula C12H14N2OS and molecular weight 234.08 g/mol. IUPAC: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)propanamide.
Chemical Property Profile of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide
Property Insights of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide
The XLogP value of 2.38552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide. With a topological polar surface area (TPSA) of 34.36 Ų, (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide has 0 hydrogen bond donor(s) and 2 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-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide?
The CAS number of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide is 313404-84-1.
What is the molecular formula of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide?
The molecular formula of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide is C12H14N2OS.
What is the molecular weight of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide?
The molecular weight of (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide is 234.08 g/mol.
Where can I buy (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide?
You can request a quote for (E)-N-(3,6-dimethylbenzo[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 (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3,6-dimethylbenzo[d]thiazol-2(3H)-ylidene)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.