3-Nitro-N,N-dipropylbenzenesulfonamide
TL;DR: 3-Nitro-N,N-dipropylbenzenesulfonamide (CAS 89840-76-6) is a chemical compound with molecular formula C12H18N2O4S and molecular weight 286.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N,N-dipropylbenzenesulfonamide
Also Known As: 3-Nitro-N,N-dipropylbenzenesulfonamide, Benzenesulfonamide, 3-nitro-N,N-dipropyl-, 3-nitro-N,N-dipropylbenzene-1-sulfonamide, [(3-nitrophenyl)sulfonyl]dipropylamine, 3-Nitro-N,N-di-n-propylbenzenesulfonamide
| Molecular Formula | C12H18N2O4S |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.09872 |
| Heavy Atoms | 19 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 89840-76-6 |
|---|---|
| SMILES | CCCN(CCC)S(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-] |
| InChIKey | VDXRCDGJYBNCSP-UHFFFAOYSA-N |
Product Overview
3-Nitro-N,N-dipropylbenzenesulfonamide (CAS 89840-76-6), with molecular formula C12H18N2O4S and molecular weight 286.10 g/mol. IUPAC: 3-nitro-N,N-dipropylbenzenesulfonamide.
Chemical Property Profile of 3-Nitro-N,N-dipropylbenzenesulfonamide
Property Insights of 3-Nitro-N,N-dipropylbenzenesulfonamide
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-N,N-dipropylbenzenesulfonamide. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-N,N-dipropylbenzenesulfonamide. Following Lipinski's Rule of Five, 3-Nitro-N,N-dipropylbenzenesulfonamide has 0 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 3-Nitro-N,N-dipropylbenzenesulfonamide?
The CAS number of 3-Nitro-N,N-dipropylbenzenesulfonamide is 89840-76-6.
What is the molecular formula of 3-Nitro-N,N-dipropylbenzenesulfonamide?
The molecular formula of 3-Nitro-N,N-dipropylbenzenesulfonamide is C12H18N2O4S.
What is the molecular weight of 3-Nitro-N,N-dipropylbenzenesulfonamide?
The molecular weight of 3-Nitro-N,N-dipropylbenzenesulfonamide is 286.10 g/mol.
Where can I buy 3-Nitro-N,N-dipropylbenzenesulfonamide?
You can request a quote for 3-Nitro-N,N-dipropylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-N,N-dipropylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-N,N-dipropylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.