BAS 06400651
TL;DR: BAS 06400651 (CAS 392298-07-6) is a chemical compound with molecular formula C21H23FN4O2S2 and molecular weight 446.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide
Also Known As: BAS 06400651, F0417-0925, (3r,5r,7r)-N-(5-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)adamantane-1-carboxamide, N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide, N-[5-({[(2-FLUOROPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,3,4-THIADIAZOL-2-YL]ADAMANTANE-1-CARBOXAMIDE
| Molecular Formula | C21H23FN4O2S2 |
|---|---|
| Molecular Weight | 446.12 g/mol |
| LogP | 4.5629 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.12463 |
| Heavy Atoms | 30 |
| Complexity | 944.13666 |
Chemical Identifiers
| CAS Number | 392298-07-6 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NN=C(S4)SCC(=O)NC5=CC=CC=C5F |
Product Overview
BAS 06400651 (CAS 392298-07-6), with molecular formula C21H23FN4O2S2 and molecular weight 446.12 g/mol. IUPAC: N-[5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide.
Chemical Property Profile of BAS 06400651
Property Insights of BAS 06400651
The XLogP value of 4.5629 indicates that BAS 06400651 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06400651. Following Lipinski's Rule of Five, BAS 06400651 has 2 hydrogen bond donor(s) and 6 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 06400651?
The CAS number of BAS 06400651 is 392298-07-6.
What is the molecular formula of BAS 06400651?
The molecular formula of BAS 06400651 is C21H23FN4O2S2.
What is the molecular weight of BAS 06400651?
The molecular weight of BAS 06400651 is 446.12 g/mol.
Where can I buy BAS 06400651?
You can request a quote for BAS 06400651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06400651?
Yes, KEHONG BIO provides custom synthesis services for BAS 06400651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.