BAS 10422827
TL;DR: BAS 10422827 (CAS 876714-38-4) is a chemical compound with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-2-methylpropan-1-one
Also Known As: BAS 10422827, 1-{3-(furan-2-yl)-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}-2-methylpropan-1-one, 1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-2-methylpropan-1-one, 1-(3-(furan-2-yl)-5-((thiophen-2-ylmethyl)amino)-1H-1,2,4-triazol-1-yl)-2-methylpropan-1-one, 1-[3-(FURAN-2-YL)-5-{[(THIOPHEN-2-YL)METHYL]AMINO}-1H-1,2,4-TRIAZOL-1-YL]-2-METHYLPROPAN-1-ONE
| Molecular Formula | C15H16N4O2S |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 3.5079 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.0994 |
| Heavy Atoms | 22 |
| Complexity | 744.71405 |
Chemical Identifiers
| CAS Number | 876714-38-4 |
|---|---|
| SMILES | CC(C)C(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=CS3 |
Product Overview
BAS 10422827 (CAS 876714-38-4), with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol. IUPAC: 1-[3-(furan-2-yl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-2-methylpropan-1-one.
Chemical Property Profile of BAS 10422827
Property Insights of BAS 10422827
The XLogP value of 3.5079 indicates that BAS 10422827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.95 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10422827. Following Lipinski's Rule of Five, BAS 10422827 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 10422827?
The CAS number of BAS 10422827 is 876714-38-4.
What is the molecular formula of BAS 10422827?
The molecular formula of BAS 10422827 is C15H16N4O2S.
What is the molecular weight of BAS 10422827?
The molecular weight of BAS 10422827 is 316.10 g/mol.
Where can I buy BAS 10422827?
You can request a quote for BAS 10422827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10422827?
Yes, KEHONG BIO provides custom synthesis services for BAS 10422827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.