AN-465/41674750
TL;DR: AN-465/41674750 (CAS 531540-53-1) is a chemical compound with molecular formula C22H25N3OS2 and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Also Known As: AN-465/41674750, N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide, N-{5-[(4-tert-butylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylpropanamide, N-(5-((4-(tert-butyl)benzyl)thio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide, N-(5-{[(4-TERT-BUTYLPHENYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)-3-PHENYLPROPANAMIDE
| Molecular Formula | C22H25N3OS2 |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 5.6992 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.1439 |
| Heavy Atoms | 28 |
| Complexity | 899.53625 |
Chemical Identifiers
| CAS Number | 531540-53-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3 |
Product Overview
AN-465/41674750 (CAS 531540-53-1), with molecular formula C22H25N3OS2 and molecular weight 411.14 g/mol. IUPAC: N-[5-[(4-tert-butylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide.
Chemical Property Profile of AN-465/41674750
Property Insights of AN-465/41674750
The XLogP value of 5.6992 indicates that AN-465/41674750 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AN-465/41674750 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-465/41674750 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/41674750?
The CAS number of AN-465/41674750 is 531540-53-1.
What is the molecular formula of AN-465/41674750?
The molecular formula of AN-465/41674750 is C22H25N3OS2.
What is the molecular weight of AN-465/41674750?
The molecular weight of AN-465/41674750 is 411.14 g/mol.
Where can I buy AN-465/41674750?
You can request a quote for AN-465/41674750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41674750?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41674750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.