AB00684290-01
TL;DR: AB00684290-01 (CAS 392318-62-6) is a chemical compound with molecular formula C15H18N4O5S3 and molecular weight 430.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-[[4-(dimethylsulfamoyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
Also Known As: AB00684290-01, F0417-2088, ethyl 2-((5-(4-(N,N-dimethylsulfamoyl)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetate, ethyl 2-({5-[4-(dimethylsulfamoyl)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetate, Ethyl 2-[[5-[[4-(dimethylsulfamoyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
| Molecular Formula | C15H18N4O5S3 |
|---|---|
| Molecular Weight | 430.04 g/mol |
| LogP | 1.6959 |
| Topological Polar Surface Area | 118.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.04395 |
| Heavy Atoms | 27 |
| Complexity | 909.7885 |
Chemical Identifiers
| CAS Number | 392318-62-6 |
|---|---|
| SMILES | CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C |
Product Overview
AB00684290-01 (CAS 392318-62-6), with molecular formula C15H18N4O5S3 and molecular weight 430.04 g/mol. IUPAC: ethyl 2-[[5-[[4-(dimethylsulfamoyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of AB00684290-01
Property Insights of AB00684290-01
The XLogP value of 1.6959 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684290-01. The TPSA of 118.56 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684290-01. Following Lipinski's Rule of Five, AB00684290-01 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 AB00684290-01?
The CAS number of AB00684290-01 is 392318-62-6.
What is the molecular formula of AB00684290-01?
The molecular formula of AB00684290-01 is C15H18N4O5S3.
What is the molecular weight of AB00684290-01?
The molecular weight of AB00684290-01 is 430.04 g/mol.
Where can I buy AB00684290-01?
You can request a quote for AB00684290-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684290-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684290-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.