1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)
TL;DR: 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) (CAS 100300-10-5) is a chemical compound with molecular formula C22H30N4O6S2 and molecular weight 510.16068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)sulfonyl-3-[6-[(4-methylphenyl)sulfonylcarbamoylamino]hexyl]urea
Also Known As: 1,1'-HEXAMETHYLENEBIS(3-(P-TOLUENESULFONAMIDO)UREA), 1-(4-methylphenyl)sulfonyl-3-[6-[(4-methylphenyl)sulfonylcarbamoylamino]hexyl]urea, 3-(4-methylphenyl)sulfonyl-1-[6-[(4-methylphenyl)sulfonylcarbamoylamino]hexyl]urea, 3-[(4-methylbenzene)sulfonyl]-1-[6-({[(4-methylbenzene)sulfonyl]carbamoyl}amino)hexyl]urea, 665-762-4
Technical Specifications
| Molecular Formula | C22H30N4O6S2 |
| Molecular Weight | 510.16068 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 167.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 510.16068 Da |
| Heavy Atoms | 34 |
| Complexity | 779.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NCCCCCCNC(=O)NS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | NPPPLMSXWLQNLW-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)
Property Insights of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)
The XLogP value of 3.2 indicates that 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)?
The CAS number of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) is 100300-10-5.
What is the molecular formula of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)?
The molecular formula of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) is C22H30N4O6S2.
What is the molecular weight of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)?
The molecular weight of 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) is 510.16068 g/mol.
Where can I buy 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)?
You can request a quote for 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea)?
Yes, CoreyChem provides custom synthesis services for 1,1'-Hexamethylenebis(3-(P-toluenesulfonamido)urea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.