AN-648/14914392
TL;DR: AN-648/14914392 (CAS 443295-93-0) 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-[4-methyl-5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide
Also Known As: AN-648/14914392, N-(4-(4-methyl-5-((2-oxo-2-(p-tolylamino)ethyl)thio)-4H-1,2,4-triazol-3-yl)phenyl)-3-phenylpropanamide, N-[4-(4-methyl-5-{[2-oxo-2-(4-toluidino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]-3-phenylpropanamide, N-[4-[4-methyl-5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide, N-{4-[4-methyl-5-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}-3-phenylpropanamide
| Molecular Formula | C27H27N5O2S |
|---|---|
| Molecular Weight | 485.19 g/mol |
| LogP | 5.09262 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 485.18854 |
| Heavy Atoms | 35 |
| Complexity | 1285.6683 |
Chemical Identifiers
| CAS Number | 443295-93-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4 |
Product Overview
AN-648/14914392 (CAS 443295-93-0), with molecular formula C27H27N5O2S and molecular weight 485.19 g/mol. IUPAC: N-[4-[4-methyl-5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide.
Chemical Property Profile of AN-648/14914392
Property Insights of AN-648/14914392
The XLogP value of 5.09262 indicates that AN-648/14914392 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-648/14914392. Following Lipinski's Rule of Five, AN-648/14914392 has 2 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-648/14914392?
The CAS number of AN-648/14914392 is 443295-93-0.
What is the molecular formula of AN-648/14914392?
The molecular formula of AN-648/14914392 is C27H27N5O2S.
What is the molecular weight of AN-648/14914392?
The molecular weight of AN-648/14914392 is 485.19 g/mol.
Where can I buy AN-648/14914392?
You can request a quote for AN-648/14914392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/14914392?
Yes, KEHONG BIO provides custom synthesis services for AN-648/14914392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.