![Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate structure](/static/products/889/889583-36-2.png)
Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate
TL;DR: Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate (CAS 889583-36-2) is a chemical compound with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-methylthiophene-3-carboxylate
Also Known As: methyl 2-(2-(4-benzylpiperazin-1-yl)acetamido)-5-methylthiophene-3-carboxylate, Methyl 2-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-methyl-thiophene-3-carboxylate, methyl 2-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-methylthiophene-3-carboxylate, methyl 2-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-methylthiophene-3-carboxylate, methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate
| Molecular Formula | C20H25N3O3S |
|---|---|
| Molecular Weight | 387.16 g/mol |
| LogP | 2.59942 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.16165 |
| Heavy Atoms | 27 |
| Complexity | 783.02454 |
Chemical Identifiers
| CAS Number | 889583-36-2 |
|---|---|
| SMILES | CC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)C(=O)OC |
Product Overview
Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate (CAS 889583-36-2), with molecular formula C20H25N3O3S and molecular weight 387.16 g/mol. IUPAC: methyl 2-[[2-(4-benzylpiperazin-1-yl)acetyl]amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate
Property Insights of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate
The XLogP value of 2.59942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate. Following Lipinski's Rule of Five, Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate 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 Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate?
The CAS number of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate is 889583-36-2.
What is the molecular formula of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate?
The molecular formula of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate is C20H25N3O3S.
What is the molecular weight of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate?
The molecular weight of Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate is 387.16 g/mol.
Where can I buy Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate?
You can request a quote for Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-methyl-2-{2-[4-benzylpiperazinyl]acetylamino}thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.