BAS 10768906
TL;DR: BAS 10768906 (CAS 876718-45-5) is a chemical compound with molecular formula C16H20FN5O2S and molecular weight 365.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-fluorophenyl)-2-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 10768906, N-(3-fluorophenyl)-2-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-(3-fluorophenyl)-2-{[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C16H20FN5O2S |
|---|---|
| Molecular Weight | 365.13 g/mol |
| LogP | 1.5172 |
| Topological Polar Surface Area | 72.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 365.13217 |
| Heavy Atoms | 25 |
| Complexity | 733.0652 |
Chemical Identifiers
| CAS Number | 876718-45-5 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)F)CN3CCOCC3 |
Product Overview
BAS 10768906 (CAS 876718-45-5), with molecular formula C16H20FN5O2S and molecular weight 365.13 g/mol. IUPAC: N-(3-fluorophenyl)-2-[[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 10768906
Property Insights of BAS 10768906
The XLogP value of 1.5172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10768906. The TPSA of 72.28 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10768906. Following Lipinski's Rule of Five, BAS 10768906 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 10768906?
The CAS number of BAS 10768906 is 876718-45-5.
What is the molecular formula of BAS 10768906?
The molecular formula of BAS 10768906 is C16H20FN5O2S.
What is the molecular weight of BAS 10768906?
The molecular weight of BAS 10768906 is 365.13 g/mol.
Where can I buy BAS 10768906?
You can request a quote for BAS 10768906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10768906?
Yes, KEHONG BIO provides custom synthesis services for BAS 10768906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.