AB00668316-01
TL;DR: AB00668316-01 (CAS 450346-63-1) is a chemical compound with molecular formula C14H13FN4O2S2 and molecular weight 352.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-fluorophenyl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
Also Known As: AB00668316-01, F0544-0032, N-(4-fluorophenyl)-2-((8-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio)acetamide, N-(4-fluorophenyl)-2-({8-oxo-5H,6H,7H,8H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl}sulfanyl)acetamide, N-(4-fluorophenyl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
| Molecular Formula | C14H13FN4O2S2 |
|---|---|
| Molecular Weight | 352.05 g/mol |
| LogP | 2.4936 |
| Topological Polar Surface Area | 74.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0464 |
| Heavy Atoms | 23 |
| Complexity | 690.5226 |
Chemical Identifiers
| CAS Number | 450346-63-1 |
|---|---|
| SMILES | C1CC(=O)N=C2N(C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
AB00668316-01 (CAS 450346-63-1), with molecular formula C14H13FN4O2S2 and molecular weight 352.05 g/mol. IUPAC: N-(4-fluorophenyl)-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 AB00668316-01
Property Insights of AB00668316-01
The XLogP value of 2.4936 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668316-01. The TPSA of 74.13 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668316-01. Following Lipinski's Rule of Five, AB00668316-01 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 AB00668316-01?
The CAS number of AB00668316-01 is 450346-63-1.
What is the molecular formula of AB00668316-01?
The molecular formula of AB00668316-01 is C14H13FN4O2S2.
What is the molecular weight of AB00668316-01?
The molecular weight of AB00668316-01 is 352.05 g/mol.
Where can I buy AB00668316-01?
You can request a quote for AB00668316-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668316-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668316-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.