BAS 00435992
TL;DR: BAS 00435992 (CAS 331710-49-7) is a chemical compound with molecular formula C19H16N4O3S and molecular weight 380.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 00435992, N-(furan-2-ylmethyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, 2-((5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(furan-2-ylmethyl)acetamide, N-Furan-2-ylmethyl-2-(5-furan-2-yl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide, N-(furan-2-ylmethyl)-2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C19H16N4O3S |
|---|---|
| Molecular Weight | 380.09 g/mol |
| LogP | 3.5288 |
| Topological Polar Surface Area | 86.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.0943 |
| Heavy Atoms | 27 |
| Complexity | 995.2128 |
Chemical Identifiers
| CAS Number | 331710-49-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NCC3=CC=CO3)C4=CC=CO4 |
Product Overview
BAS 00435992 (CAS 331710-49-7), with molecular formula C19H16N4O3S and molecular weight 380.09 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 00435992
Property Insights of BAS 00435992
The XLogP value of 3.5288 indicates that BAS 00435992 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00435992. Following Lipinski's Rule of Five, BAS 00435992 has 1 hydrogen bond donor(s) and 6 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 00435992?
The CAS number of BAS 00435992 is 331710-49-7.
What is the molecular formula of BAS 00435992?
The molecular formula of BAS 00435992 is C19H16N4O3S.
What is the molecular weight of BAS 00435992?
The molecular weight of BAS 00435992 is 380.09 g/mol.
Where can I buy BAS 00435992?
You can request a quote for BAS 00435992 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00435992?
Yes, KEHONG BIO provides custom synthesis services for BAS 00435992 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.