BAS 03999270
TL;DR: BAS 03999270 (CAS 557066-37-2) is a chemical compound with molecular formula C22H21N5O3S2 and molecular weight 467.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Also Known As: BAS 03999270, 2-({5-[(4-methoxyphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide, 2-[[5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
| Molecular Formula | C22H21N5O3S2 |
|---|---|
| Molecular Weight | 467.11 g/mol |
| LogP | 4.35062 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 467.10858 |
| Heavy Atoms | 32 |
| Complexity | 1176.0167 |
Chemical Identifiers
| CAS Number | 557066-37-2 |
|---|---|
| SMILES | CC1=CSC(=N1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)COC4=CC=C(C=C4)OC |
Product Overview
BAS 03999270 (CAS 557066-37-2), with molecular formula C22H21N5O3S2 and molecular weight 467.11 g/mol. IUPAC: 2-[[5-[(4-methoxyphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of BAS 03999270
Property Insights of BAS 03999270
The XLogP value of 4.35062 indicates that BAS 03999270 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03999270. Following Lipinski's Rule of Five, BAS 03999270 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 03999270?
The CAS number of BAS 03999270 is 557066-37-2.
What is the molecular formula of BAS 03999270?
The molecular formula of BAS 03999270 is C22H21N5O3S2.
What is the molecular weight of BAS 03999270?
The molecular weight of BAS 03999270 is 467.11 g/mol.
Where can I buy BAS 03999270?
You can request a quote for BAS 03999270 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03999270?
Yes, KEHONG BIO provides custom synthesis services for BAS 03999270 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.