![2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide structure](/static/products/6252/6252-80-8.webp)
2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide
TL;DR: 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide (CAS 6252-80-8) is a chemical compound with molecular formula C15H14N2O4S2 and molecular weight 350.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetylsulfonyl-N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide
Also Known As: 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide, 2-acetylsulfonyl-N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide, 2-acetylsulfonyl-N-(6-methyl-3-prop-2-ynyl-benzothiazol-2-ylidene)acetamide, 2-(Ethanesulfonyl)-N-[(2Z)-6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide
| Molecular Formula | C15H14N2O4S2 |
|---|---|
| Molecular Weight | 350.04 g/mol |
| LogP | 1.03302 |
| Topological Polar Surface Area | 85.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.0395 |
| Heavy Atoms | 23 |
| Complexity | 1004.2519 |
Chemical Identifiers
| CAS Number | 6252-80-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)C(=O)C)S2)CC#C |
Product Overview
2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide (CAS 6252-80-8), with molecular formula C15H14N2O4S2 and molecular weight 350.04 g/mol. IUPAC: 2-acetylsulfonyl-N-(6-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)acetamide.
Chemical Property Profile of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide
Property Insights of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide
The XLogP value of 1.03302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide. The TPSA of 85.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide. Following Lipinski's Rule of Five, 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-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 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide?
The CAS number of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide is 6252-80-8.
What is the molecular formula of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide?
The molecular formula of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide is C15H14N2O4S2.
What is the molecular weight of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide?
The molecular weight of 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide is 350.04 g/mol.
Where can I buy 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide?
You can request a quote for 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-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 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.