F0544-0154
TL;DR: F0544-0154 (CAS 681273-18-7) is a chemical compound with molecular formula C14H21N5O3S2 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(8-oxo-2-sulfanylidene-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-3-yl)methyl]piperazine-1-carboxylate
Also Known As: F0544-0154, ethyl 4-((8-oxo-2-thioxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-3(2H)-yl)methyl)piperazine-1-carboxylate, ethyl 4-({8-oxo-2-sulfanylidene-2H,3H,5H,6H,7H,8H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-3-yl}methyl)piperazine-1-carboxylate, ethyl 4-[(8-oxo-2-sulfanylidene-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-3-yl)methyl]piperazine-1-carboxylate
| Molecular Formula | C14H21N5O3S2 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 0.9451 |
| Topological Polar Surface Area | 68.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.10858 |
| Heavy Atoms | 24 |
| Complexity | 562.61316 |
Chemical Identifiers
| CAS Number | 681273-18-7 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CN2C(=S)SC3=NC(=O)CCCN32 |
Product Overview
F0544-0154 (CAS 681273-18-7), with molecular formula C14H21N5O3S2 and molecular weight 371.11 g/mol. IUPAC: ethyl 4-[(8-oxo-2-sulfanylidene-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-3-yl)methyl]piperazine-1-carboxylate.
Chemical Property Profile of F0544-0154
Property Insights of F0544-0154
The XLogP value of 0.9451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0544-0154. The TPSA of 68.69 Ų falls within the moderate polarity range, balancing permeability and solubility for F0544-0154. Following Lipinski's Rule of Five, F0544-0154 has 0 hydrogen bond donor(s) and 7 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 F0544-0154?
The CAS number of F0544-0154 is 681273-18-7.
What is the molecular formula of F0544-0154?
The molecular formula of F0544-0154 is C14H21N5O3S2.
What is the molecular weight of F0544-0154?
The molecular weight of F0544-0154 is 371.11 g/mol.
Where can I buy F0544-0154?
You can request a quote for F0544-0154 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0544-0154?
Yes, KEHONG BIO provides custom synthesis services for F0544-0154 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.