(2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile
TL;DR: (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile (CAS 136773-71-2) is a chemical compound with molecular formula C18H12N2S and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile
Also Known As: (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile, VU0492677-1, F3139-1252, 2-(Benzo[d]thiazol-2-yl)-5-phenylpenta-2,4-dienenitrile, (2E,4E)-2-benzothiazol-2-yl-5-phenylpenta-2,4-dienenitrile
| Molecular Formula | C18H12N2S |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.0721 |
| Heavy Atoms | 21 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 136773-71-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C(\C#N)/C2=NC3=CC=CC=C3S2 |
| InChIKey | FAJVPGPPLKOGEJ-UJHPFZFGSA-N |
Product Overview
(2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile (CAS 136773-71-2), with molecular formula C18H12N2S and molecular weight 288.07 g/mol. IUPAC: (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile.
Chemical Property Profile of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile
Property Insights of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile
The XLogP value of 4.8 indicates that (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile. Following Lipinski's Rule of Five, (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile 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 (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile?
The CAS number of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile is 136773-71-2.
What is the molecular formula of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile?
The molecular formula of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile is C18H12N2S.
What is the molecular weight of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile?
The molecular weight of (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile is 288.07 g/mol.
Where can I buy (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile?
You can request a quote for (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E,4E)-2-(1,3-benzothiazol-2-yl)-5-phenylpenta-2,4-dienenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.