AB00614482-06
TL;DR: AB00614482-06 (CAS 689751-99-3) is a chemical compound with molecular formula C18H23N5O6S2 and molecular weight 469.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-methyl-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: AB00614482-06, F0601-0112, methyl 2-((4-methyl-5-((4-(morpholinosulfonyl)benzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate, methyl 2-{[4-methyl-5-({[4-(morpholine-4-sulfonyl)phenyl]formamido}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate, methyl 2-[[4-methyl-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
| Molecular Formula | C18H23N5O6S2 |
|---|---|
| Molecular Weight | 469.11 g/mol |
| LogP | 0.0311 |
| Topological Polar Surface Area | 132.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.10898 |
| Heavy Atoms | 31 |
| Complexity | 1032.2098 |
Chemical Identifiers
| CAS Number | 689751-99-3 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)OC)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3 |
Product Overview
AB00614482-06 (CAS 689751-99-3), with molecular formula C18H23N5O6S2 and molecular weight 469.11 g/mol. IUPAC: methyl 2-[[4-methyl-5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of AB00614482-06
Property Insights of AB00614482-06
The XLogP value of 0.0311 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00614482-06. The TPSA of 132.72 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00614482-06. Following Lipinski's Rule of Five, AB00614482-06 has 1 hydrogen bond donor(s) and 9 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 AB00614482-06?
The CAS number of AB00614482-06 is 689751-99-3.
What is the molecular formula of AB00614482-06?
The molecular formula of AB00614482-06 is C18H23N5O6S2.
What is the molecular weight of AB00614482-06?
The molecular weight of AB00614482-06 is 469.11 g/mol.
Where can I buy AB00614482-06?
You can request a quote for AB00614482-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00614482-06?
Yes, KEHONG BIO provides custom synthesis services for AB00614482-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.