4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide
TL;DR: 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide (CAS 1027-12-9) is a chemical compound with molecular formula C8H12ClN3O4S2 and molecular weight 312.9958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-6-chloro-1-N,3-N-dimethylbenzene-1,3-disulfonamide
Also Known As: Hydrochlorothiazide Impurity 29, m-Benzenedisulfonamide, 4-amino-6-chloro-N,N'-dimethyl-, K 572, 4-amino-6-chloro-1-N,3-N-dimethylbenzene-1,3-disulfonamide, 2-Chloro-6-amino-3,5-benzenedisulphonmethylamide
Technical Specifications
| Molecular Formula | C8H12ClN3O4S2 |
| Molecular Weight | 312.9958 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.9958 Da |
| Heavy Atoms | 18 |
| Complexity | 481.0 |
| SMILES | CNS(=O)(=O)C1=CC(=C(C=C1N)Cl)S(=O)(=O)NC |
| InChIKey | OETUDWYVNUKHJY-UHFFFAOYSA-N |
Chemical Property Profile of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide
Property Insights of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide. Following Lipinski's Rule of Five, 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide?
The CAS number of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide is 1027-12-9.
What is the molecular formula of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide?
The molecular formula of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide is C8H12ClN3O4S2.
What is the molecular weight of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide?
The molecular weight of 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide is 312.9958 g/mol.
Where can I buy 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide?
You can request a quote for 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-Amino-6-chloro-N1,N3-dimethyl-1,3-benzenedisulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.