BAS 00447772
TL;DR: BAS 00447772 (CAS 6063-83-8) is a chemical compound with molecular formula C21H26N2O2 and molecular weight 338.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
Also Known As: BAS 00447772, N-(1-adamantyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide, N-(ADAMANTAN-1-YL)-5-OXO-1-PHENYLPYRROLIDINE-3-CARBOXAMIDE, N-1-adamantyl-5-oxo-1-phenyl-3-pyrrolidinecarboxamide, 5-Oxo-1-phenyl-pyrrolidine-3-carboxylic acid adamantan-1-ylamide
| Molecular Formula | C21H26N2O2 |
|---|---|
| Molecular Weight | 338.20 g/mol |
| LogP | 3.1245 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.19943 |
| Heavy Atoms | 25 |
| Complexity | 663.8232 |
Chemical Identifiers
| CAS Number | 6063-83-8 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)C4CC(=O)N(C4)C5=CC=CC=C5 |
Product Overview
BAS 00447772 (CAS 6063-83-8), with molecular formula C21H26N2O2 and molecular weight 338.20 g/mol. IUPAC: N-(1-adamantyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.
Chemical Property Profile of BAS 00447772
Property Insights of BAS 00447772
The XLogP value of 3.1245 indicates that BAS 00447772 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 00447772 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00447772 has 1 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 BAS 00447772?
The CAS number of BAS 00447772 is 6063-83-8.
What is the molecular formula of BAS 00447772?
The molecular formula of BAS 00447772 is C21H26N2O2.
What is the molecular weight of BAS 00447772?
The molecular weight of BAS 00447772 is 338.20 g/mol.
Where can I buy BAS 00447772?
You can request a quote for BAS 00447772 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00447772?
Yes, KEHONG BIO provides custom synthesis services for BAS 00447772 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.