ChemDiv1_020751
TL;DR: ChemDiv1_020751 (CAS 325988-50-9) is a chemical compound with molecular formula C26H25N3O4S3 and molecular weight 539.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-morpholin-4-ylsulfonylbenzamide
Also Known As: ChemDiv1_020751, F0289-0286, N-[3-(1,3-BENZOTHIAZOL-2-YL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL]-4-(MORPHOLINE-4-SULFONYL)BENZAMIDE, N-(3-(benzo[d]thiazol-2-yl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-4-(morpholinosulfonyl)benzamide, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-morpholin-4-ylsulfonylbenzamide
| Molecular Formula | C26H25N3O4S3 |
|---|---|
| Molecular Weight | 539.10 g/mol |
| LogP | 5.1768 |
| Topological Polar Surface Area | 88.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 539.1007 |
| Heavy Atoms | 36 |
| Complexity | 1501.4166 |
Chemical Identifiers
| CAS Number | 325988-50-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=NC6=CC=CC=C6S5 |
Product Overview
ChemDiv1_020751 (CAS 325988-50-9), with molecular formula C26H25N3O4S3 and molecular weight 539.10 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of ChemDiv1_020751
Property Insights of ChemDiv1_020751
The XLogP value of 5.1768 indicates that ChemDiv1_020751 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_020751. Following Lipinski's Rule of Five, ChemDiv1_020751 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_020751?
The CAS number of ChemDiv1_020751 is 325988-50-9.
What is the molecular formula of ChemDiv1_020751?
The molecular formula of ChemDiv1_020751 is C26H25N3O4S3.
What is the molecular weight of ChemDiv1_020751?
The molecular weight of ChemDiv1_020751 is 539.10 g/mol.
Where can I buy ChemDiv1_020751?
You can request a quote for ChemDiv1_020751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020751?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.