N-1-adamantyl-N'-(2-chlorobenzyl)urea
TL;DR: N-1-adamantyl-N'-(2-chlorobenzyl)urea (CAS 123614-29-9) is a chemical compound with molecular formula C18H23ClN2O and molecular weight 318.1499 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-adamantyl)-3-[(2-chlorophenyl)methyl]urea
Also Known As: N-1-adamantyl-N'-(2-chlorobenzyl)urea, N-(1-adamantyl)-N'-(2-chlorobenzyl)urea, 1-(adamantan-1-yl)-3-(2-chlorobenzyl)urea, 1-(1-adamantyl)-3-[(2-chlorophenyl)methyl]urea, N-adamantanyl{[(2-chlorophenyl)methyl]amino}carboxamide
Technical Specifications
| Molecular Formula | C18H23ClN2O |
| Molecular Weight | 318.1499 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.1499 Da |
| Heavy Atoms | 22 |
| Complexity | 398.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=CC=C4Cl |
| InChIKey | LDSUASYLBNOUFL-UHFFFAOYSA-N |
Chemical Property Profile of N-1-adamantyl-N'-(2-chlorobenzyl)urea
Property Insights of N-1-adamantyl-N'-(2-chlorobenzyl)urea
The XLogP value of 4.2 indicates that N-1-adamantyl-N'-(2-chlorobenzyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, N-1-adamantyl-N'-(2-chlorobenzyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-1-adamantyl-N'-(2-chlorobenzyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-1-adamantyl-N'-(2-chlorobenzyl)urea?
The CAS number of N-1-adamantyl-N'-(2-chlorobenzyl)urea is 123614-29-9.
What is the molecular formula of N-1-adamantyl-N'-(2-chlorobenzyl)urea?
The molecular formula of N-1-adamantyl-N'-(2-chlorobenzyl)urea is C18H23ClN2O.
What is the molecular weight of N-1-adamantyl-N'-(2-chlorobenzyl)urea?
The molecular weight of N-1-adamantyl-N'-(2-chlorobenzyl)urea is 318.1499 g/mol.
Where can I buy N-1-adamantyl-N'-(2-chlorobenzyl)urea?
You can request a quote for N-1-adamantyl-N'-(2-chlorobenzyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-1-adamantyl-N'-(2-chlorobenzyl)urea?
Yes, CoreyChem provides custom synthesis services for N-1-adamantyl-N'-(2-chlorobenzyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.