BAS 04209407
TL;DR: BAS 04209407 (CAS 498550-53-1) is a chemical compound with molecular formula C25H24N4O5S and molecular weight 492.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 04209407, ASN 04209407, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[4-(furan-2-ylmethyl)-5-(4-methylphenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C25H24N4O5S |
|---|---|
| Molecular Weight | 492.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 492.14673 |
| Heavy Atoms | 35 |
| Complexity | 682.0 |
Chemical Identifiers
| CAS Number | 498550-53-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC5=C(C=C4)OCCO5 |
| InChIKey | LPOKFBQPZOCLMH-UHFFFAOYSA-N |
Product Overview
BAS 04209407 (CAS 498550-53-1), with molecular formula C25H24N4O5S and molecular weight 492.15 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[4-(furan-2-ylmethyl)-5-[(4-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 04209407
Property Insights of BAS 04209407
The XLogP value of 3.5 indicates that BAS 04209407 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04209407. Following Lipinski's Rule of Five, BAS 04209407 has 1 hydrogen bond donor(s) and 8 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 04209407?
The CAS number of BAS 04209407 is 498550-53-1.
What is the molecular formula of BAS 04209407?
The molecular formula of BAS 04209407 is C25H24N4O5S.
What is the molecular weight of BAS 04209407?
The molecular weight of BAS 04209407 is 492.15 g/mol.
Where can I buy BAS 04209407?
You can request a quote for BAS 04209407 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04209407?
Yes, KEHONG BIO provides custom synthesis services for BAS 04209407 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.