3,3'-Hexamethylenebis(1-methyl-1-phenylurea)
TL;DR: 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) (CAS 5132-94-5) is a chemical compound with molecular formula C22H30N4O2 and molecular weight 382.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[6-[[methyl(phenyl)carbamoyl]amino]hexyl]-1-phenylurea
Also Known As: 3,3'-HEXAMETHYLENEBIS(1-METHYL-1-PHENYLUREA), 1-methyl-3-[6-[(methyl-phenyl-carbamoyl)amino]hexyl]-1-phenyl-urea, 1-methyl-3-[6-[[methyl(phenyl)carbamoyl]amino]hexyl]-1-phenylurea, 667-417-3, RefChem:485006
| Molecular Formula | C22H30N4O2 |
|---|---|
| Molecular Weight | 382.24 g/mol |
| LogP | 4.2388 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 382.23688 |
| Heavy Atoms | 28 |
| Complexity | 658.3313 |
Chemical Identifiers
| CAS Number | 5132-94-5 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)NCCCCCCNC(=O)N(C)C2=CC=CC=C2 |
Product Overview
3,3'-Hexamethylenebis(1-methyl-1-phenylurea) (CAS 5132-94-5), with molecular formula C22H30N4O2 and molecular weight 382.24 g/mol. IUPAC: 1-methyl-3-[6-[[methyl(phenyl)carbamoyl]amino]hexyl]-1-phenylurea.
Chemical Property Profile of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)
Property Insights of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)
The XLogP value of 4.2388 indicates that 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Hexamethylenebis(1-methyl-1-phenylurea). Following Lipinski's Rule of Five, 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) has 2 hydrogen bond donor(s) and 2 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 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)?
The CAS number of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) is 5132-94-5.
What is the molecular formula of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)?
The molecular formula of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) is C22H30N4O2.
What is the molecular weight of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)?
The molecular weight of 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) is 382.24 g/mol.
Where can I buy 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)?
You can request a quote for 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Hexamethylenebis(1-methyl-1-phenylurea)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Hexamethylenebis(1-methyl-1-phenylurea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.