AB00684419-01
TL;DR: AB00684419-01 (CAS 497063-75-9) is a chemical compound with molecular formula C13H14N4O3S2 and molecular weight 338.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
Also Known As: AB00684419-01, F0544-0043, N-(furan-2-ylmethyl)-2-((8-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio)acetamide, N-[(furan-2-yl)methyl]-2-({8-oxo-5H,6H,7H,8H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl}sulfanyl)acetamide, N-(furan-2-ylmethyl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
| Molecular Formula | C13H14N4O3S2 |
|---|---|
| Molecular Weight | 338.05 g/mol |
| LogP | 1.6252 |
| Topological Polar Surface Area | 87.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.05072 |
| Heavy Atoms | 22 |
| Complexity | 627.23956 |
Chemical Identifiers
| CAS Number | 497063-75-9 |
|---|---|
| SMILES | C1CC(=O)N=C2N(C1)N=C(S2)SCC(=O)NCC3=CC=CO3 |
Product Overview
AB00684419-01 (CAS 497063-75-9), with molecular formula C13H14N4O3S2 and molecular weight 338.05 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00684419-01
Property Insights of AB00684419-01
The XLogP value of 1.6252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684419-01. The TPSA of 87.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684419-01. Following Lipinski's Rule of Five, AB00684419-01 has 1 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 AB00684419-01?
The CAS number of AB00684419-01 is 497063-75-9.
What is the molecular formula of AB00684419-01?
The molecular formula of AB00684419-01 is C13H14N4O3S2.
What is the molecular weight of AB00684419-01?
The molecular weight of AB00684419-01 is 338.05 g/mol.
Where can I buy AB00684419-01?
You can request a quote for AB00684419-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684419-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684419-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.