ChemDiv1_005074
TL;DR: ChemDiv1_005074 (CAS 394227-08-8) is a chemical compound with molecular formula C29H23N3O3S2 and molecular weight 525.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide
Also Known As: ChemDiv1_005074, F0737-0074, 4-(2,3-dihydro-1H-indole-1-sulfonyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide, 4-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide, 4-(indolin-1-ylsulfonyl)-N-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)benzamide
| Molecular Formula | C29H23N3O3S2 |
|---|---|
| Molecular Weight | 525.12 g/mol |
| LogP | 6.27542 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 525.1181 |
| Heavy Atoms | 37 |
| Complexity | 1742.0707 |
Chemical Identifiers
| CAS Number | 394227-08-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCC6=CC=CC=C65 |
Product Overview
ChemDiv1_005074 (CAS 394227-08-8), with molecular formula C29H23N3O3S2 and molecular weight 525.12 g/mol. IUPAC: 4-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]benzamide.
Chemical Property Profile of ChemDiv1_005074
Property Insights of ChemDiv1_005074
The XLogP value of 6.27542 indicates that ChemDiv1_005074 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005074. Following Lipinski's Rule of Five, ChemDiv1_005074 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_005074?
The CAS number of ChemDiv1_005074 is 394227-08-8.
What is the molecular formula of ChemDiv1_005074?
The molecular formula of ChemDiv1_005074 is C29H23N3O3S2.
What is the molecular weight of ChemDiv1_005074?
The molecular weight of ChemDiv1_005074 is 525.12 g/mol.
Where can I buy ChemDiv1_005074?
You can request a quote for ChemDiv1_005074 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005074?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005074 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.