![6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole structure](/static/products/3122/312285-33-9.webp)
6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
TL;DR: 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole (CAS 312285-33-9) is a chemical compound with molecular formula C17H15N5O4S and molecular weight 385.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
Also Known As: BIM-0038862.P001, 6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole, 6-nitro-2-[4-(4-nitrophenyl)piperazinyl]benzothiazole, A1780/0075504, 6-nitro-2-(4-{4-nitrophenyl}-1-piperazinyl)-1,3-benzothiazole
| Molecular Formula | C17H15N5O4S |
|---|---|
| Molecular Weight | 385.08 g/mol |
| LogP | 3.4393 |
| Topological Polar Surface Area | 105.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.08447 |
| Heavy Atoms | 27 |
| Complexity | 1011.8406 |
Chemical Identifiers
| CAS Number | 312285-33-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-] |
Product Overview
6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole (CAS 312285-33-9), with molecular formula C17H15N5O4S and molecular weight 385.08 g/mol. IUPAC: 6-nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole.
Chemical Property Profile of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
Property Insights of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole
The XLogP value of 3.4393 indicates that 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole. Following Lipinski's Rule of Five, 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole has 0 hydrogen bond donor(s) and 8 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 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole?
The CAS number of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole is 312285-33-9.
What is the molecular formula of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole?
The molecular formula of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole is C17H15N5O4S.
What is the molecular weight of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole?
The molecular weight of 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole is 385.08 g/mol.
Where can I buy 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole?
You can request a quote for 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitro-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.