![5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide structure](/static/products/5453/545342-31-2.webp)
5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide
TL;DR: 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide (CAS 545342-31-2) is a chemical compound with molecular formula C19H19ClN2O2S and molecular weight 374.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-methoxybenzamide
Also Known As: 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide, 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-methoxybenzamide, (5-chloro-2-methoxyphenyl)-N-(3-cyano(4,5,6,7,8,9-hexahydrocycloocta[2,1-d]thi ophen-2-yl))carboxamide
| Molecular Formula | C19H19ClN2O2S |
|---|---|
| Molecular Weight | 374.09 g/mol |
| LogP | 5.19308 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 374.08557 |
| Heavy Atoms | 25 |
| Complexity | 838.6801 |
Chemical Identifiers
| CAS Number | 545342-31-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)C(=O)NC2=C(C3=C(S2)CCCCCC3)C#N |
Product Overview
5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide (CAS 545342-31-2), with molecular formula C19H19ClN2O2S and molecular weight 374.09 g/mol. IUPAC: 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-methoxybenzamide.
Chemical Property Profile of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide
Property Insights of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide
The XLogP value of 5.19308 indicates that 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide. Following Lipinski's Rule of Five, 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide?
The CAS number of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide is 545342-31-2.
What is the molecular formula of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide?
The molecular formula of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide is C19H19ClN2O2S.
What is the molecular weight of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide?
The molecular weight of 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide is 374.09 g/mol.
Where can I buy 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide?
You can request a quote for 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thien-2-yl)-2-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.