TL;DR: 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) (CAS 111017-17-5) is a chemical compound with molecular formula C18H24N4O2 and molecular weight 328.1899 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-propyl-3-[5-(propylcarbamoylamino)naphthalen-1-yl]urea
Also Known As: 1,1'-(1,5-NAPHTHALENEDIYL)BIS(3-PROPYLUREA), 1-propyl-3-[5-(propylcarbamoylamino)naphthalen-1-yl]urea, 3,3'-(1,5-NAPHTHALENEDIYL)BIS(1,1-DIPROPYLUREA), 3-propyl-1-[5-(propylcarbamoylamino)naphthalen-1-yl]urea, 3-propyl-1-{5-[(propylcarbamoyl)amino]naphthalen-1-yl}urea
| Molecular Formula | C18H24N4O2 |
| Molecular Weight | 328.1899 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.1899 Da |
| Heavy Atoms | 24 |
| Complexity | 378.0 |
| SMILES | CCCNC(=O)NC1=CC=CC2=C1C=CC=C2NC(=O)NCCC |
| InChIKey | GAPDIBIUBDVPNK-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea). Following Lipinski's Rule of Five, 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) has 4 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 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) is 111017-17-5.
The molecular formula of 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) is C18H24N4O2.
The molecular weight of 1,1'-(1,5-Naphthalenediyl)bis(3-propylurea) is 328.1899 g/mol.
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