BAS 04027341
TL;DR: BAS 04027341 (CAS 557065-61-9) is a chemical compound with molecular formula C17H15N5O3S and molecular weight 369.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 04027341, N-(1,3-benzodioxol-5-yl)-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(1,3-benzodioxol-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2H-1,3-benzodioxol-5-yl)-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-2-(4-methyl-5-(3-pyridyl)(1,2,4-triazol-3 -ylthio))acetamide
| Molecular Formula | C17H15N5O3S |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 2.3366 |
| Topological Polar Surface Area | 91.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.08957 |
| Heavy Atoms | 26 |
| Complexity | 944.82635 |
Chemical Identifiers
| CAS Number | 557065-61-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)C4=CN=CC=C4 |
Product Overview
BAS 04027341 (CAS 557065-61-9), with molecular formula C17H15N5O3S and molecular weight 369.09 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 04027341
Property Insights of BAS 04027341
The XLogP value of 2.3366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04027341. The TPSA of 91.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04027341. Following Lipinski's Rule of Five, BAS 04027341 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 BAS 04027341?
The CAS number of BAS 04027341 is 557065-61-9.
What is the molecular formula of BAS 04027341?
The molecular formula of BAS 04027341 is C17H15N5O3S.
What is the molecular weight of BAS 04027341?
The molecular weight of BAS 04027341 is 369.09 g/mol.
Where can I buy BAS 04027341?
You can request a quote for BAS 04027341 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04027341?
Yes, KEHONG BIO provides custom synthesis services for BAS 04027341 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.