DivK1c_004905
TL;DR: DivK1c_004905 (CAS 332389-28-3) is a chemical compound with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(5-acetamido-3-acetyl-2-phenyl-1,3,4-thiadiazol-2-yl)acetate
Also Known As: DivK1c_004905, CDS1_003865, BIM-0017339.P001, ethyl [3-acetyl-5-(acetylamino)-2-phenyl-2,3-dihydro-1,3,4-thiadiazol-2-yl]acetate, ethyl 2-(5-acetamido-3-acetyl-2-phenyl-1,3,4-thiadiazol-2-yl)acetate
| Molecular Formula | C16H19N3O4S |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 1.795 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.10962 |
| Heavy Atoms | 24 |
| Complexity | 677.1599 |
Chemical Identifiers
| CAS Number | 332389-28-3 |
|---|---|
| SMILES | CCOC(=O)CC1(N(N=C(S1)NC(=O)C)C(=O)C)C2=CC=CC=C2 |
Product Overview
DivK1c_004905 (CAS 332389-28-3), with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol. IUPAC: ethyl 2-(5-acetamido-3-acetyl-2-phenyl-1,3,4-thiadiazol-2-yl)acetate.
Chemical Property Profile of DivK1c_004905
Property Insights of DivK1c_004905
The XLogP value of 1.795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DivK1c_004905. The TPSA of 88.07 Ų falls within the moderate polarity range, balancing permeability and solubility for DivK1c_004905. Following Lipinski's Rule of Five, DivK1c_004905 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 DivK1c_004905?
The CAS number of DivK1c_004905 is 332389-28-3.
What is the molecular formula of DivK1c_004905?
The molecular formula of DivK1c_004905 is C16H19N3O4S.
What is the molecular weight of DivK1c_004905?
The molecular weight of DivK1c_004905 is 349.11 g/mol.
Where can I buy DivK1c_004905?
You can request a quote for DivK1c_004905 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DivK1c_004905?
Yes, KEHONG BIO provides custom synthesis services for DivK1c_004905 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.