BAS 00924100
TL;DR: BAS 00924100 (CAS 355416-71-6) is a chemical compound with molecular formula C16H18N4O5S and molecular weight 378.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: BAS 00924100, ethyl 2-[({3-nitro-5-methyl-1H-pyrazol-1-yl}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-(2-(5-methyl-3-nitro-1H-pyrazol-1-yl)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ethyl 2-{[(5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C16H18N4O5S |
|---|---|
| Molecular Weight | 378.10 g/mol |
| LogP | 2.46532 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.0998 |
| Heavy Atoms | 26 |
| Complexity | 885.5774 |
Chemical Identifiers
| CAS Number | 355416-71-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CN3C(=CC(=N3)[N+](=O)[O-])C |
Product Overview
BAS 00924100 (CAS 355416-71-6), with molecular formula C16H18N4O5S and molecular weight 378.10 g/mol. IUPAC: ethyl 2-[[2-(5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of BAS 00924100
Property Insights of BAS 00924100
The XLogP value of 2.46532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00924100. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00924100. Following Lipinski's Rule of Five, BAS 00924100 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 BAS 00924100?
The CAS number of BAS 00924100 is 355416-71-6.
What is the molecular formula of BAS 00924100?
The molecular formula of BAS 00924100 is C16H18N4O5S.
What is the molecular weight of BAS 00924100?
The molecular weight of BAS 00924100 is 378.10 g/mol.
Where can I buy BAS 00924100?
You can request a quote for BAS 00924100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00924100?
Yes, KEHONG BIO provides custom synthesis services for BAS 00924100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.