SDCCGSBI-0658500.P001
TL;DR: SDCCGSBI-0658500.P001 (CAS 876712-61-7) is a chemical compound with molecular formula C18H11N7OS and molecular weight 373.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-benzofuran-2-yl)-3-(benzotriazol-1-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: SDCCGSBI-0658500.P001, BAS 10124258, 6-(1-benzofuran-2-yl)-3-(benzotriazol-1-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43113229, 1-{[6-(1-benzofuran-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-1,2,3-benzotriazole
| Molecular Formula | C18H11N7OS |
|---|---|
| Molecular Weight | 373.07 g/mol |
| LogP | 3.392 |
| Topological Polar Surface Area | 86.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.0746 |
| Heavy Atoms | 27 |
| Complexity | 1390.6365 |
Chemical Identifiers
| CAS Number | 876712-61-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C3=NN4C(=NN=C4S3)CN5C6=CC=CC=C6N=N5 |
Product Overview
SDCCGSBI-0658500.P001 (CAS 876712-61-7), with molecular formula C18H11N7OS and molecular weight 373.07 g/mol. IUPAC: 6-(1-benzofuran-2-yl)-3-(benzotriazol-1-ylmethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of SDCCGSBI-0658500.P001
Property Insights of SDCCGSBI-0658500.P001
The XLogP value of 3.392 indicates that SDCCGSBI-0658500.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.93 Ų falls within the moderate polarity range, balancing permeability and solubility for SDCCGSBI-0658500.P001. Following Lipinski's Rule of Five, SDCCGSBI-0658500.P001 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 SDCCGSBI-0658500.P001?
The CAS number of SDCCGSBI-0658500.P001 is 876712-61-7.
What is the molecular formula of SDCCGSBI-0658500.P001?
The molecular formula of SDCCGSBI-0658500.P001 is C18H11N7OS.
What is the molecular weight of SDCCGSBI-0658500.P001?
The molecular weight of SDCCGSBI-0658500.P001 is 373.07 g/mol.
Where can I buy SDCCGSBI-0658500.P001?
You can request a quote for SDCCGSBI-0658500.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SDCCGSBI-0658500.P001?
Yes, KEHONG BIO provides custom synthesis services for SDCCGSBI-0658500.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.