ChemDiv1_020707
TL;DR: ChemDiv1_020707 (CAS 325988-46-3) is a chemical compound with molecular formula C20H15ClN2OS3 and molecular weight 430.00 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]-5-chlorothiophene-2-carboxamide
Also Known As: ChemDiv1_020707, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-chlorothiophene-2-carboxamide, F0289-0272, N-(3-(benzo[d]thiazol-2-yl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-5-chlorothiophene-2-carboxamide
| Molecular Formula | C20H15ClN2OS3 |
|---|---|
| Molecular Weight | 430.00 g/mol |
| LogP | 6.8708 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 430.0035 |
| Heavy Atoms | 27 |
| Complexity | 1124.3683 |
Chemical Identifiers
| CAS Number | 325988-46-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(S3)Cl)C4=NC5=CC=CC=C5S4 |
Product Overview
ChemDiv1_020707 (CAS 325988-46-3), with molecular formula C20H15ClN2OS3 and molecular weight 430.00 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-chlorothiophene-2-carboxamide.
Chemical Property Profile of ChemDiv1_020707
Property Insights of ChemDiv1_020707
The XLogP value of 6.8708 indicates that ChemDiv1_020707 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, ChemDiv1_020707 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_020707 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_020707?
The CAS number of ChemDiv1_020707 is 325988-46-3.
What is the molecular formula of ChemDiv1_020707?
The molecular formula of ChemDiv1_020707 is C20H15ClN2OS3.
What is the molecular weight of ChemDiv1_020707?
The molecular weight of ChemDiv1_020707 is 430.00 g/mol.
Where can I buy ChemDiv1_020707?
You can request a quote for ChemDiv1_020707 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020707?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.