2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one
TL;DR: 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one (CAS 134633-29-7) is a chemical compound with molecular formula C11H9N3OS and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylmethyl)-1,3-thiazol-4-one
Also Known As: Tecogalan sodium, NCI60_011012, 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one, 2-(1H-benzimidazol-2-ylmethyl)thiazol-4-one, 2-(1H-benzimidazol-2-ylmethyl)-1,3-thiazol-4-one
| Molecular Formula | C11H9N3OS |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.04663 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 134633-29-7 |
|---|---|
| SMILES | C1C(=O)N=C(S1)CC2=NC3=CC=CC=C3N2 |
| InChIKey | IJSXLHIMKVVISB-UHFFFAOYSA-N |
Product Overview
2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one (CAS 134633-29-7), with molecular formula C11H9N3OS and molecular weight 231.05 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylmethyl)-1,3-thiazol-4-one.
Chemical Property Profile of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one
Property Insights of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one. Following Lipinski's Rule of Five, 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one has 1 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-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one?
The CAS number of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one is 134633-29-7.
What is the molecular formula of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one?
The molecular formula of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one is C11H9N3OS.
What is the molecular weight of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one?
The molecular weight of 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one is 231.05 g/mol.
Where can I buy 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one?
You can request a quote for 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-Benzimidazol-2-ylmethyl)-1,3-thiazol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.