![3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide structure](/static/products/920/92064-63-6.png)
3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide
TL;DR: 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide (CAS 92064-63-6) is a chemical compound with molecular formula C10H9ClN2OS2 and molecular weight 271.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide
Also Known As: 3-[(5-Chloro-2-benzothiazolyl)thio]propanamide, 3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide
| Molecular Formula | C10H9ClN2OS2 |
|---|---|
| Molecular Weight | 271.98 g/mol |
| LogP | 2.9172 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.9845 |
| Heavy Atoms | 16 |
| Complexity | 526.5134 |
Chemical Identifiers
| CAS Number | 92064-63-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)N=C(S2)SCCC(=O)N |
Product Overview
3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide (CAS 92064-63-6), with molecular formula C10H9ClN2OS2 and molecular weight 271.98 g/mol. IUPAC: 3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide.
Chemical Property Profile of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide
Property Insights of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide
The XLogP value of 2.9172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide. With a topological polar surface area (TPSA) of 55.98 Ų, 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide has 1 hydrogen bond donor(s) and 4 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 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide?
The CAS number of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide is 92064-63-6.
What is the molecular formula of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide?
The molecular formula of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide is C10H9ClN2OS2.
What is the molecular weight of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide?
The molecular weight of 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide is 271.98 g/mol.
Where can I buy 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide?
You can request a quote for 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.