3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide
TL;DR: 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide (CAS 53641-52-4) is a chemical compound with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide
Also Known As: IFLab1_000540, IDI1_008759, 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide, 3,4-dimethoxy-N-[(2Z)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzamide, (Z)-3,4-dimethoxy-N-(3-methylbenzo[d]thiazol-2(3H)-ylidene)benzamide
| Molecular Formula | C17H16N2O3S |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 2.9981 |
| Topological Polar Surface Area | 52.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.08817 |
| Heavy Atoms | 23 |
| Complexity | 940.4066 |
Chemical Identifiers
| CAS Number | 53641-52-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2SC1=NC(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide (CAS 53641-52-4), with molecular formula C17H16N2O3S and molecular weight 328.09 g/mol. IUPAC: 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide.
Chemical Property Profile of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide
Property Insights of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide
The XLogP value of 2.9981 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide. With a topological polar surface area (TPSA) of 52.82 Ų, 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide 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 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide?
The CAS number of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide is 53641-52-4.
What is the molecular formula of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide?
The molecular formula of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide is C17H16N2O3S.
What is the molecular weight of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide?
The molecular weight of 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide is 328.09 g/mol.
Where can I buy 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide?
You can request a quote for 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethoxy-N-(3-methyl-1,3-benzothiazol-2-ylidene)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.