ASN 13689627
TL;DR: ASN 13689627 (CAS 887690-33-7) is a chemical compound with molecular formula C18H20N4O4S2 and molecular weight 420.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine
Also Known As: ASN 13689627, 3-((4-(4-(methylsulfonyl)piperazin-1-yl)phenyl)amino)benzo[d]isothiazole 1,1-dioxide, 3-{4-[4-(METHYLSULFONYL)PIPERAZINO]ANILINO}-1H-1,2-BENZISOTHIAZOLE-1,1-DIONE, N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine, N-{4-[4-(methylsulfonyl)piperazin-1-yl]phenyl}-1,2-benzothiazol-3-amine 1,1-dioxide
| Molecular Formula | C18H20N4O4S2 |
|---|---|
| Molecular Weight | 420.09 g/mol |
| LogP | 1.3292 |
| Topological Polar Surface Area | 99.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.0926 |
| Heavy Atoms | 28 |
| Complexity | 1134.363 |
Chemical Identifiers
| CAS Number | 887690-33-7 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NS(=O)(=O)C4=CC=CC=C43 |
Product Overview
ASN 13689627 (CAS 887690-33-7), with molecular formula C18H20N4O4S2 and molecular weight 420.09 g/mol. IUPAC: N-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]-1,1-dioxo-1,2-benzothiazol-3-amine.
Chemical Property Profile of ASN 13689627
Property Insights of ASN 13689627
The XLogP value of 1.3292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 13689627. The TPSA of 99.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 13689627. Following Lipinski's Rule of Five, ASN 13689627 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 ASN 13689627?
The CAS number of ASN 13689627 is 887690-33-7.
What is the molecular formula of ASN 13689627?
The molecular formula of ASN 13689627 is C18H20N4O4S2.
What is the molecular weight of ASN 13689627?
The molecular weight of ASN 13689627 is 420.09 g/mol.
Where can I buy ASN 13689627?
You can request a quote for ASN 13689627 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 13689627?
Yes, KEHONG BIO provides custom synthesis services for ASN 13689627 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.