AB00672369-01
TL;DR: AB00672369-01 (CAS 394232-92-9) is a chemical compound with molecular formula C16H19N3O5S2 and molecular weight 397.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanylacetate
Also Known As: AB00672369-01, F0748-0164, ethyl 2-[({[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]acetate, ethyl 2-((2-((5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)acetate, ethyl 2-[2-[[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanylacetate
| Molecular Formula | C16H19N3O5S2 |
|---|---|
| Molecular Weight | 397.08 g/mol |
| LogP | 2.4571 |
| Topological Polar Surface Area | 99.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 397.0766 |
| Heavy Atoms | 26 |
| Complexity | 766.0935 |
Chemical Identifiers
| CAS Number | 394232-92-9 |
|---|---|
| SMILES | CCOC(=O)CSCC(=O)NC1=NN=C(S1)C2=C(C=C(C=C2)OC)OC |
Product Overview
AB00672369-01 (CAS 394232-92-9), with molecular formula C16H19N3O5S2 and molecular weight 397.08 g/mol. IUPAC: ethyl 2-[2-[[5-(2,4-dimethoxyphenyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]sulfanylacetate.
Chemical Property Profile of AB00672369-01
Property Insights of AB00672369-01
The XLogP value of 2.4571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00672369-01. The TPSA of 99.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672369-01. Following Lipinski's Rule of Five, AB00672369-01 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 AB00672369-01?
The CAS number of AB00672369-01 is 394232-92-9.
What is the molecular formula of AB00672369-01?
The molecular formula of AB00672369-01 is C16H19N3O5S2.
What is the molecular weight of AB00672369-01?
The molecular weight of AB00672369-01 is 397.08 g/mol.
Where can I buy AB00672369-01?
You can request a quote for AB00672369-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672369-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672369-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.