BIM-0043830.P001
TL;DR: BIM-0043830.P001 (CAS 328277-49-2) is a chemical compound with molecular formula C18H22N4O5S and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BIM-0043830.P001, propyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, propyl 2-{[(5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, propyl 2-(2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, propyl 2-[({3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H22N4O5S |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 3.24552 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.1311 |
| Heavy Atoms | 28 |
| Complexity | 917.4629 |
Chemical Identifiers
| CAS Number | 328277-49-2 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C(=CC(=N3)[N+](=O)[O-])C |
Product Overview
BIM-0043830.P001 (CAS 328277-49-2), with molecular formula C18H22N4O5S and molecular weight 406.13 g/mol. IUPAC: propyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BIM-0043830.P001
Property Insights of BIM-0043830.P001
The XLogP value of 3.24552 indicates that BIM-0043830.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0043830.P001. Following Lipinski's Rule of Five, BIM-0043830.P001 has 1 hydrogen bond donor(s) and 7 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-0043830.P001?
The CAS number of BIM-0043830.P001 is 328277-49-2.
What is the molecular formula of BIM-0043830.P001?
The molecular formula of BIM-0043830.P001 is C18H22N4O5S.
What is the molecular weight of BIM-0043830.P001?
The molecular weight of BIM-0043830.P001 is 406.13 g/mol.
Where can I buy BIM-0043830.P001?
You can request a quote for BIM-0043830.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0043830.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0043830.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.