![(Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile structure](/static/products/1256/1256281-40-9.webp)
(Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile
TL;DR: (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile (CAS 1256281-40-9) is a chemical compound with molecular formula C10H8N2S and molecular weight 188.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-1,3-benzothiazol-2-ylidene)acetonitrile
Also Known As: 2-(3-methyl-1,3-benzothiazol-2-ylidene)acetonitrile, (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile
| Molecular Formula | C10H8N2S |
|---|---|
| Molecular Weight | 188.04 g/mol |
| LogP | 2.59348 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.04082 |
| Heavy Atoms | 13 |
| Complexity | 403.63092 |
Chemical Identifiers
| CAS Number | 1256281-40-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2SC1=CC#N |
Product Overview
(Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile (CAS 1256281-40-9), with molecular formula C10H8N2S and molecular weight 188.04 g/mol. IUPAC: 2-(3-methyl-1,3-benzothiazol-2-ylidene)acetonitrile.
Chemical Property Profile of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile
Property Insights of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile
The XLogP value of 2.59348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile. With a topological polar surface area (TPSA) of 27.03 Ų, (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile has 0 hydrogen bond donor(s) and 3 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-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile?
The CAS number of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile is 1256281-40-9.
What is the molecular formula of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile?
The molecular formula of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile is C10H8N2S.
What is the molecular weight of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile?
The molecular weight of (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile is 188.04 g/mol.
Where can I buy (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile?
You can request a quote for (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-[3-Methylbenzo[d]thiazol-2(3H)-ylidene]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.