TL;DR: 3,3'-Hexamethylenebis(1,1-dipropylurea) (CAS 138049-24-8) is a chemical compound with molecular formula C20H42N4O2 and molecular weight 370.33078 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[6-(dipropylcarbamoylamino)hexyl]-1,1-dipropylurea
Also Known As: BAS 02374297, 3,3'-HEXAMETHYLENEBIS(1,1-DIPROPYLUREA), 3-[6-(dipropylcarbamoylamino)hexyl]-1,1-dipropylurea, BRD-K04223278-001-01-2, 3-[6-(3,3-Dipropyl-ureido)-hexyl]-1,1-dipropyl-urea
| Molecular Formula | C20H42N4O2 |
| Molecular Weight | 370.33078 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 64.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 370.33078 Da |
| Heavy Atoms | 26 |
| Complexity | 318.0 |
| SMILES | CCCN(CCC)C(=O)NCCCCCCNC(=O)N(CCC)CCC |
| InChIKey | NLFNPYUYNBAFKK-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that 3,3'-Hexamethylenebis(1,1-dipropylurea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Hexamethylenebis(1,1-dipropylurea). Following Lipinski's Rule of Five, 3,3'-Hexamethylenebis(1,1-dipropylurea) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,3'-Hexamethylenebis(1,1-dipropylurea) is 138049-24-8.
The molecular formula of 3,3'-Hexamethylenebis(1,1-dipropylurea) is C20H42N4O2.
The molecular weight of 3,3'-Hexamethylenebis(1,1-dipropylurea) is 370.33078 g/mol.
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