![3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide structure](/static/products/5384/5384-20-3.webp)
3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide
TL;DR: 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide (CAS 5384-20-3) is a chemical compound with molecular formula C16H15N5O7S2 and molecular weight 453.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide
Also Known As: 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide, 3-Nitro-4-{2-[1-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propan-2-ylidene]hydrazin-1-yl}benzene-1-sulfonamide
| Molecular Formula | C16H15N5O7S2 |
|---|---|
| Molecular Weight | 453.04 g/mol |
| LogP | 0.8747 |
| Topological Polar Surface Area | 182.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.0413 |
| Heavy Atoms | 30 |
| Complexity | 1303.014 |
Chemical Identifiers
| CAS Number | 5384-20-3 |
|---|---|
| SMILES | CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-])CN2C(=O)C3=CC=CC=C3S2(=O)=O |
Product Overview
3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide (CAS 5384-20-3), with molecular formula C16H15N5O7S2 and molecular weight 453.04 g/mol. IUPAC: 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide.
Chemical Property Profile of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide
Property Insights of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide
The XLogP value of 0.8747 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide. The TPSA of 182.14 Ų indicates high polarity, suggesting 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide has 2 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 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide?
The CAS number of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide is 5384-20-3.
What is the molecular formula of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide?
The molecular formula of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide is C16H15N5O7S2.
What is the molecular weight of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide?
The molecular weight of 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide is 453.04 g/mol.
Where can I buy 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide?
You can request a quote for 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.