![N-adamantanyl[(3-chlorophenyl)amino]carboxamide structure](/static/products/1236/123614-27-7.webp)
N-adamantanyl[(3-chlorophenyl)amino]carboxamide
TL;DR: N-adamantanyl[(3-chlorophenyl)amino]carboxamide (CAS 123614-27-7) is a chemical compound with molecular formula C17H21ClN2O and molecular weight 304.13425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1-adamantyl)-3-(3-chlorophenyl)urea
Also Known As: N-adamantanyl[(3-chlorophenyl)amino]carboxamide, 1-(1-adamantyl)-3-(3-chlorophenyl)urea, AB00110729-01, 1-((3s,5s,7s)-adamantan-1-yl)-3-(3-chlorophenyl)urea
Technical Specifications
| Molecular Formula | C17H21ClN2O |
| Molecular Weight | 304.13425 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.13425 Da |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)NC4=CC(=CC=C4)Cl |
| InChIKey | QKZRGYUHXORTIG-UHFFFAOYSA-N |
Chemical Property Profile of N-adamantanyl[(3-chlorophenyl)amino]carboxamide
Property Insights of N-adamantanyl[(3-chlorophenyl)amino]carboxamide
The XLogP value of 4.2 indicates that N-adamantanyl[(3-chlorophenyl)amino]carboxamide 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-adamantanyl[(3-chlorophenyl)amino]carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-adamantanyl[(3-chlorophenyl)amino]carboxamide 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-adamantanyl[(3-chlorophenyl)amino]carboxamide?
The CAS number of N-adamantanyl[(3-chlorophenyl)amino]carboxamide is 123614-27-7.
What is the molecular formula of N-adamantanyl[(3-chlorophenyl)amino]carboxamide?
The molecular formula of N-adamantanyl[(3-chlorophenyl)amino]carboxamide is C17H21ClN2O.
What is the molecular weight of N-adamantanyl[(3-chlorophenyl)amino]carboxamide?
The molecular weight of N-adamantanyl[(3-chlorophenyl)amino]carboxamide is 304.13425 g/mol.
Where can I buy N-adamantanyl[(3-chlorophenyl)amino]carboxamide?
You can request a quote for N-adamantanyl[(3-chlorophenyl)amino]carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-adamantanyl[(3-chlorophenyl)amino]carboxamide?
Yes, CoreyChem provides custom synthesis services for N-adamantanyl[(3-chlorophenyl)amino]carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.