BAS 12975502
TL;DR: BAS 12975502 (CAS 515875-39-5) is a chemical compound with molecular formula C14H8Cl2N4O2S and molecular weight 365.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2,4-dichlorophenoxy)methyl]-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 12975502, 6-[(2,4-dichlorophenoxy)methyl]-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43300814, 2,4-dichlorophenyl [3-(2-furyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl ether, 6-(2,4-dichlorophenoxymethyl)-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C14H8Cl2N4O2S |
|---|---|
| Molecular Weight | 365.97 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.9745 |
| Heavy Atoms | 23 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 515875-39-5 |
|---|---|
| SMILES | C1=COC(=C1)C2=NN=C3N2N=C(S3)COC4=C(C=C(C=C4)Cl)Cl |
| InChIKey | RSVUNMIJFOWNJN-UHFFFAOYSA-N |
Product Overview
BAS 12975502 (CAS 515875-39-5), with molecular formula C14H8Cl2N4O2S and molecular weight 365.97 g/mol. IUPAC: 6-[(2,4-dichlorophenoxy)methyl]-3-(furan-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 12975502
Property Insights of BAS 12975502
The XLogP value of 3.8 indicates that BAS 12975502 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12975502. Following Lipinski's Rule of Five, BAS 12975502 has 0 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 BAS 12975502?
The CAS number of BAS 12975502 is 515875-39-5.
What is the molecular formula of BAS 12975502?
The molecular formula of BAS 12975502 is C14H8Cl2N4O2S.
What is the molecular weight of BAS 12975502?
The molecular weight of BAS 12975502 is 365.97 g/mol.
Where can I buy BAS 12975502?
You can request a quote for BAS 12975502 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12975502?
Yes, KEHONG BIO provides custom synthesis services for BAS 12975502 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.