Trisulfamid
TL;DR: Trisulfamid (CAS 812-13-5) is a chemical compound with molecular formula C29H33N11O7S3 and molecular weight 743.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;(4-aminophenyl)sulfonylurea;4-amino-N-pyrimidin-2-ylbenzenesulfonamide
Also Known As: Trisulfamid, Sulfacarbamide mixture with sulfadiazine and sulfamethazine, 4-amino-n-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;(4-aminophenyl)sulfonylurea; 4-amino-n-pyrimidin-2-yl-benzenesulfonamide, 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;(4-aminophenyl)sulfonylurea;4-amino-N-pyrimidin-2-ylbenzenesulfonamide, 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide,(4-aminophenyl)sulfonylurea,4-amino-N-pyrimidin-2-ylbenzenesulfonamide
| Molecular Formula | C29H33N11O7S3 |
|---|---|
| Molecular Weight | 743.17 g/mol |
| LogP | 1.96184 |
| Topological Polar Surface Area | 336.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 743.17267 |
| Heavy Atoms | 50 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 812-13-5 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C.C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N.C1=CC(=CC=C1N)S(=O)(=O)NC(=O)N |
| InChIKey | QLAFFCFPRBDMCE-UHFFFAOYSA-N |
Product Overview
Trisulfamid (CAS 812-13-5), with molecular formula C29H33N11O7S3 and molecular weight 743.17 g/mol. IUPAC: 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;(4-aminophenyl)sulfonylurea;4-amino-N-pyrimidin-2-ylbenzenesulfonamide.
Chemical Property Profile of Trisulfamid
Property Insights of Trisulfamid
The XLogP value of 1.96184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trisulfamid. The TPSA of 336.0 Ų indicates high polarity, suggesting Trisulfamid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trisulfamid has 7 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trisulfamid?
The CAS number of Trisulfamid is 812-13-5.
What is the molecular formula of Trisulfamid?
The molecular formula of Trisulfamid is C29H33N11O7S3.
What is the molecular weight of Trisulfamid?
The molecular weight of Trisulfamid is 743.17 g/mol.
Where can I buy Trisulfamid?
You can request a quote for Trisulfamid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trisulfamid?
Yes, KEHONG BIO provides custom synthesis services for Trisulfamid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.