ChemDiv1_022207
TL;DR: ChemDiv1_022207 (CAS 394227-16-8) is a chemical compound with molecular formula C30H25N3O3S3 and molecular weight 571.11 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-(2,3-dihydroindol-1-ylsulfonyl)benzamide
Also Known As: ChemDiv1_022207, F0737-0101, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydro-1H-indole-1-sulfonyl)benzamide, N-(3-(benzo[d]thiazol-2-yl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-4-(indolin-1-ylsulfonyl)benzamide, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydroindol-1-ylsulfonyl)benzamide
| Molecular Formula | C30H25N3O3S3 |
|---|---|
| Molecular Weight | 571.11 g/mol |
| LogP | 6.9073 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 571.10583 |
| Heavy Atoms | 39 |
| Complexity | 1805.3665 |
Chemical Identifiers
| CAS Number | 394227-16-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C54)C6=NC7=CC=CC=C7S6 |
Product Overview
ChemDiv1_022207 (CAS 394227-16-8), with molecular formula C30H25N3O3S3 and molecular weight 571.11 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-(2,3-dihydroindol-1-ylsulfonyl)benzamide.
Chemical Property Profile of ChemDiv1_022207
Property Insights of ChemDiv1_022207
The XLogP value of 6.9073 indicates that ChemDiv1_022207 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_022207. Following Lipinski's Rule of Five, ChemDiv1_022207 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_022207?
The CAS number of ChemDiv1_022207 is 394227-16-8.
What is the molecular formula of ChemDiv1_022207?
The molecular formula of ChemDiv1_022207 is C30H25N3O3S3.
What is the molecular weight of ChemDiv1_022207?
The molecular weight of ChemDiv1_022207 is 571.11 g/mol.
Where can I buy ChemDiv1_022207?
You can request a quote for ChemDiv1_022207 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022207?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022207 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.