BAS 00472953
TL;DR: BAS 00472953 (CAS 327025-65-0) is a chemical compound with molecular formula C17H18Cl2N2OS and molecular weight 368.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxamide
Also Known As: BAS 00472953, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxamide
| Molecular Formula | C17H18Cl2N2OS |
|---|---|
| Molecular Weight | 368.05 g/mol |
| LogP | 5.02828 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 368.0517 |
| Heavy Atoms | 23 |
| Complexity | 725.6872 |
Chemical Identifiers
| CAS Number | 327025-65-0 |
|---|---|
| SMILES | CC1(C(C1C(=O)NC2=C(C3=C(S2)CCCC3)C#N)C=C(Cl)Cl)C |
Product Overview
BAS 00472953 (CAS 327025-65-0), with molecular formula C17H18Cl2N2OS and molecular weight 368.05 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxamide.
Chemical Property Profile of BAS 00472953
Property Insights of BAS 00472953
The XLogP value of 5.02828 indicates that BAS 00472953 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, BAS 00472953 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00472953 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00472953?
The CAS number of BAS 00472953 is 327025-65-0.
What is the molecular formula of BAS 00472953?
The molecular formula of BAS 00472953 is C17H18Cl2N2OS.
What is the molecular weight of BAS 00472953?
The molecular weight of BAS 00472953 is 368.05 g/mol.
Where can I buy BAS 00472953?
You can request a quote for BAS 00472953 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00472953?
Yes, KEHONG BIO provides custom synthesis services for BAS 00472953 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.