![4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol structure](/static/products/5685/568559-01-3.webp)
4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol
TL;DR: 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol (CAS 568559-01-3) is a chemical compound with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-6-yl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
Also Known As: KSC-287-057, 4-[4-(1,3-benzothiazole-6-carbonyl)piperazin-1-yl]phenol, 1,3-benzothiazol-6-yl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
| Molecular Formula | C18H17N3O2S |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 2.9643 |
| Topological Polar Surface Area | 56.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.10416 |
| Heavy Atoms | 24 |
| Complexity | 867.3611 |
Chemical Identifiers
| CAS Number | 568559-01-3 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)O)C(=O)C3=CC4=C(C=C3)N=CS4 |
Product Overview
4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol (CAS 568559-01-3), with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol. IUPAC: 1,3-benzothiazol-6-yl-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol
Property Insights of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol
The XLogP value of 2.9643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol. With a topological polar surface area (TPSA) of 56.67 Ų, 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol has 1 hydrogen bond donor(s) and 5 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 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol?
The CAS number of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol is 568559-01-3.
What is the molecular formula of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol?
The molecular formula of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol is C18H17N3O2S.
What is the molecular weight of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol?
The molecular weight of 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol is 339.10 g/mol.
Where can I buy 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol?
You can request a quote for 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(1,3-Benzothiazole-6-carbonyl)piperazin-1-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.