N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide
TL;DR: N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide (CAS 797795-07-4) is a chemical compound with molecular formula C19H18N6O5S and molecular weight 442.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide
Also Known As: N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide, N-(6-nitrobenzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide, N-(6-nitrobenzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazinyl]acetamide, N-(6-nitrobenzo[d]thiazol-2-yl)-2-(4-(4-nitrophenyl)piperazin-1-yl)acetamide
| Molecular Formula | C19H18N6O5S |
|---|---|
| Molecular Weight | 442.11 g/mol |
| LogP | 2.8734 |
| Topological Polar Surface Area | 134.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.10593 |
| Heavy Atoms | 31 |
| Complexity | 1140.4008 |
Chemical Identifiers
| CAS Number | 797795-07-4 |
|---|---|
| SMILES | C1CN(CCN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide (CAS 797795-07-4), with molecular formula C19H18N6O5S and molecular weight 442.11 g/mol. IUPAC: N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide.
Chemical Property Profile of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide
Property Insights of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide
The XLogP value of 2.8734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide. The TPSA of 134.75 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide. Following Lipinski's Rule of Five, N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide has 1 hydrogen bond donor(s) and 9 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 N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide?
The CAS number of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide is 797795-07-4.
What is the molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide?
The molecular formula of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide is C19H18N6O5S.
What is the molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide?
The molecular weight of N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide is 442.11 g/mol.
Where can I buy N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide?
You can request a quote for N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-nitro-1,3-benzothiazol-2-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.