BAS 09812420
TL;DR: BAS 09812420 (CAS 847469-99-2) is a chemical compound with molecular formula C18H13ClN4O2S3 and molecular weight 447.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide
Also Known As: BAS 09812420, N-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide, N-(5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-2-(2-oxobenzo[d]thiazol-3(2H)-yl)acetamide, N-(5-{[(2-CHLOROPHENYL)METHYL]SULFANYL}-1,3,4-THIADIAZOL-2-YL)-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOTHIAZOL-3-YL)ACETAMIDE, N-[(2Z)-5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-(2-oxo-1,3-benzothiazol-3(2H)-yl)acetamide
| Molecular Formula | C18H13ClN4O2S3 |
|---|---|
| Molecular Weight | 447.99 g/mol |
| LogP | 4.4989 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.98892 |
| Heavy Atoms | 28 |
| Complexity | 1200.7393 |
Chemical Identifiers
| CAS Number | 847469-99-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=NN=C(S2)NC(=O)CN3C4=CC=CC=C4SC3=O)Cl |
Product Overview
BAS 09812420 (CAS 847469-99-2), with molecular formula C18H13ClN4O2S3 and molecular weight 447.99 g/mol. IUPAC: N-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide.
Chemical Property Profile of BAS 09812420
Property Insights of BAS 09812420
The XLogP value of 4.4989 indicates that BAS 09812420 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09812420. Following Lipinski's Rule of Five, BAS 09812420 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 BAS 09812420?
The CAS number of BAS 09812420 is 847469-99-2.
What is the molecular formula of BAS 09812420?
The molecular formula of BAS 09812420 is C18H13ClN4O2S3.
What is the molecular weight of BAS 09812420?
The molecular weight of BAS 09812420 is 447.99 g/mol.
Where can I buy BAS 09812420?
You can request a quote for BAS 09812420 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09812420?
Yes, KEHONG BIO provides custom synthesis services for BAS 09812420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.