AB01304534-01
TL;DR: AB01304534-01 (CAS 899404-31-0) is a chemical compound with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide
Also Known As: AB01304534-01, 2-{[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide, 2-((4-(furan-2-ylmethyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)-N-(3-methoxyphenyl)acetamide, 2-[[4-(2-furylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide, 2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide
| Molecular Formula | C23H22N4O4S |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 4.2378 |
| Topological Polar Surface Area | 91.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 450.13617 |
| Heavy Atoms | 32 |
| Complexity | 1146.0399 |
Chemical Identifiers
| CAS Number | 899404-31-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)COC4=CC=CC=C4 |
Product Overview
AB01304534-01 (CAS 899404-31-0), with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol. IUPAC: 2-[[4-(furan-2-ylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methoxyphenyl)acetamide.
Chemical Property Profile of AB01304534-01
Property Insights of AB01304534-01
The XLogP value of 4.2378 indicates that AB01304534-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.41 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01304534-01. Following Lipinski's Rule of Five, AB01304534-01 has 1 hydrogen bond donor(s) and 7 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 AB01304534-01?
The CAS number of AB01304534-01 is 899404-31-0.
What is the molecular formula of AB01304534-01?
The molecular formula of AB01304534-01 is C23H22N4O4S.
What is the molecular weight of AB01304534-01?
The molecular weight of AB01304534-01 is 450.14 g/mol.
Where can I buy AB01304534-01?
You can request a quote for AB01304534-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01304534-01?
Yes, KEHONG BIO provides custom synthesis services for AB01304534-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.