BIM-0049151.P001
TL;DR: BIM-0049151.P001 (CAS 353786-43-3) is a chemical compound with molecular formula C17H15ClN2O5S and molecular weight 394.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(2-chloro-4-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: BIM-0049151.P001, ethyl 2-[(2-chloro-4-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-({2-chloro-4-nitrobenzoyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-{[(2-chloro-4-nitrophenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C17H15ClN2O5S |
|---|---|
| Molecular Weight | 394.04 g/mol |
| LogP | 4.2274 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.03903 |
| Heavy Atoms | 26 |
| Complexity | 908.79846 |
Chemical Identifiers
| CAS Number | 353786-43-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl |
Product Overview
BIM-0049151.P001 (CAS 353786-43-3), with molecular formula C17H15ClN2O5S and molecular weight 394.04 g/mol. IUPAC: ethyl 2-[(2-chloro-4-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of BIM-0049151.P001
Property Insights of BIM-0049151.P001
The XLogP value of 4.2274 indicates that BIM-0049151.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0049151.P001. Following Lipinski's Rule of Five, BIM-0049151.P001 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0049151.P001?
The CAS number of BIM-0049151.P001 is 353786-43-3.
What is the molecular formula of BIM-0049151.P001?
The molecular formula of BIM-0049151.P001 is C17H15ClN2O5S.
What is the molecular weight of BIM-0049151.P001?
The molecular weight of BIM-0049151.P001 is 394.04 g/mol.
Where can I buy BIM-0049151.P001?
You can request a quote for BIM-0049151.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0049151.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0049151.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.