AN-648/14914403
TL;DR: AN-648/14914403 (CAS 425648-07-3) is a chemical compound with molecular formula C27H27N5O2S and molecular weight 485.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide
Also Known As: AN-648/14914403, N-[4-(5-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-3-phenylpropanamide, N-[4-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide, N-(4-(5-((2-(benzylamino)-2-oxoethyl)thio)-4-methyl-4H-1,2,4-triazol-3-yl)phenyl)-3-phenylpropanamide, N-[4-(5-{[2-(benzylamino)-2-oxoethyl]thio}-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-3-phenylpropanamide
| Molecular Formula | C27H27N5O2S |
|---|---|
| Molecular Weight | 485.19 g/mol |
| LogP | 4.4619 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 485.18854 |
| Heavy Atoms | 35 |
| Complexity | 1257.9983 |
Chemical Identifiers
| CAS Number | 425648-07-3 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4 |
Product Overview
AN-648/14914403 (CAS 425648-07-3), with molecular formula C27H27N5O2S and molecular weight 485.19 g/mol. IUPAC: N-[4-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide.
Chemical Property Profile of AN-648/14914403
Property Insights of AN-648/14914403
The XLogP value of 4.4619 indicates that AN-648/14914403 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/14914403. Following Lipinski's Rule of Five, AN-648/14914403 has 2 hydrogen bond donor(s) and 5 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 AN-648/14914403?
The CAS number of AN-648/14914403 is 425648-07-3.
What is the molecular formula of AN-648/14914403?
The molecular formula of AN-648/14914403 is C27H27N5O2S.
What is the molecular weight of AN-648/14914403?
The molecular weight of AN-648/14914403 is 485.19 g/mol.
Where can I buy AN-648/14914403?
You can request a quote for AN-648/14914403 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/14914403?
Yes, KEHONG BIO provides custom synthesis services for AN-648/14914403 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.