BAS 09627976
TL;DR: BAS 09627976 (CAS 701240-13-3) is a chemical compound with molecular formula C23H28N4OS and molecular weight 408.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-[[4-ethyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 09627976, N-cyclohexyl-2-[[4-ethyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-cyclohexyl-2-{[4-ethyl-5-(naphthalen-1-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-CYCLOHEXYL-2-{[4-ETHYL-5-(NAPHTHALEN-1-YLMETHYL)-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE
| Molecular Formula | C23H28N4OS |
|---|---|
| Molecular Weight | 408.20 g/mol |
| LogP | 4.583 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.1984 |
| Heavy Atoms | 29 |
| Complexity | 972.6732 |
Chemical Identifiers
| CAS Number | 701240-13-3 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2CCCCC2)CC3=CC=CC4=CC=CC=C43 |
Product Overview
BAS 09627976 (CAS 701240-13-3), with molecular formula C23H28N4OS and molecular weight 408.20 g/mol. IUPAC: N-cyclohexyl-2-[[4-ethyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 09627976
Property Insights of BAS 09627976
The XLogP value of 4.583 indicates that BAS 09627976 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, BAS 09627976 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 09627976 has 1 hydrogen bond donor(s) and 4 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 09627976?
The CAS number of BAS 09627976 is 701240-13-3.
What is the molecular formula of BAS 09627976?
The molecular formula of BAS 09627976 is C23H28N4OS.
What is the molecular weight of BAS 09627976?
The molecular weight of BAS 09627976 is 408.20 g/mol.
Where can I buy BAS 09627976?
You can request a quote for BAS 09627976 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09627976?
Yes, KEHONG BIO provides custom synthesis services for BAS 09627976 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.