dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate
TL;DR: dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate (CAS 612043-95-5) is a chemical compound with molecular formula C15H21NO6S2 and molecular weight 375.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-methyl-5-(4-methylpiperidin-1-yl)sulfonylthiophene-2,4-dicarboxylate
Also Known As: dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate, VU0100872-5, AF-399/41610734, dimethyl 3-methyl-5-(4-methylpiperidin-1-yl)sulfonylthiophene-2,4-dicarboxylate, F1360-0614
| Molecular Formula | C15H21NO6S2 |
|---|---|
| Molecular Weight | 375.08 g/mol |
| LogP | 2.05032 |
| Topological Polar Surface Area | 89.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.08102 |
| Heavy Atoms | 24 |
| Complexity | 744.259 |
Chemical Identifiers
| CAS Number | 612043-95-5 |
|---|---|
| SMILES | CC1CCN(CC1)S(=O)(=O)C2=C(C(=C(S2)C(=O)OC)C)C(=O)OC |
Product Overview
dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate (CAS 612043-95-5), with molecular formula C15H21NO6S2 and molecular weight 375.08 g/mol. IUPAC: dimethyl 3-methyl-5-(4-methylpiperidin-1-yl)sulfonylthiophene-2,4-dicarboxylate.
Chemical Property Profile of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate
Property Insights of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate
The XLogP value of 2.05032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate. The TPSA of 89.98 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate has 0 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 dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate?
The CAS number of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate is 612043-95-5.
What is the molecular formula of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate?
The molecular formula of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate is C15H21NO6S2.
What is the molecular weight of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate?
The molecular weight of dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate is 375.08 g/mol.
Where can I buy dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate?
You can request a quote for dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 3-methyl-5-[(4-methylpiperidin-1-yl)sulfonyl]thiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.