2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-
TL;DR: 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- (CAS 67726-10-7) is a chemical compound with molecular formula C13H10N2OS3 and molecular weight 306.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propan-2-one
Also Known As: 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-, 1-(4-(2-Benzothiazolyl-2-thiazolyl)thio)-2-propanone, 2-acetonylthio-4-(2-benzothiazolyl)thiazole, 1-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propan-2-one, 1-{[4-(1,3-Benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl}propan-2-one
| Molecular Formula | C13H10N2OS3 |
|---|---|
| Molecular Weight | 306.00 g/mol |
| LogP | 4.1009 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.9955 |
| Heavy Atoms | 19 |
| Complexity | 699.1556 |
Chemical Identifiers
| CAS Number | 67726-10-7 |
|---|---|
| SMILES | CC(=O)CSC1=NC(=CS1)C2=NC3=CC=CC=C3S2 |
Product Overview
2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- (CAS 67726-10-7), with molecular formula C13H10N2OS3 and molecular weight 306.00 g/mol. IUPAC: 1-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propan-2-one.
Chemical Property Profile of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-
Property Insights of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-
The XLogP value of 4.1009 indicates that 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- has 0 hydrogen bond donor(s) and 6 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-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-?
The CAS number of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- is 67726-10-7.
What is the molecular formula of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-?
The molecular formula of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- is C13H10N2OS3.
What is the molecular weight of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-?
The molecular weight of 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- is 306.00 g/mol.
Where can I buy 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-?
You can request a quote for 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1-(4-(2-benzothiazolyl-2-thiazolyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.