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2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile
TL;DR: 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile (CAS 519153-04-9) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-2-cyclopentylideneacetonitrile
Also Known As: 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile, 2-(1,3-benzothiazol-2-yl)-2-cyclopentylideneacetonitrile
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 4.14748 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 589.9548 |
Chemical Identifiers
| CAS Number | 519153-04-9 |
|---|---|
| SMILES | C1CCC(=C(C#N)C2=NC3=CC=CC=C3S2)C1 |
Product Overview
2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile (CAS 519153-04-9), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-2-cyclopentylideneacetonitrile.
Chemical Property Profile of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile
Property Insights of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile
The XLogP value of 4.14748 indicates that 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile 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 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile?
The CAS number of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile is 519153-04-9.
What is the molecular formula of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile?
The molecular formula of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile is C14H12N2S.
What is the molecular weight of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile?
The molecular weight of 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile is 240.07 g/mol.
Where can I buy 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile?
You can request a quote for 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzo[d]thiazol-2-yl)-2-cyclopentylideneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.