Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate
TL;DR: Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate (CAS 74695-30-0) is a chemical compound with molecular formula C10H11NO4S and molecular weight 241.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(3-oxobutanoylamino)thiophene-2-carboxylate
Also Known As: METHYL 3-(3-OXOBUTANAMIDO)THIOPHENE-2-CARBOXYLATE, methyl 3-(3-oxobutanoylamino)thiophene-2-carboxylate, methyl 3-(acetoacetylamino)-2-thiophenecarboxylate, 7B-030, METHYL3-(3-OXOBUTANAMIDO)THIOPHENE-2-CARBOXYLATE
| Molecular Formula | C10H11NO4S |
|---|---|
| Molecular Weight | 241.04 g/mol |
| LogP | 1.4523 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.04088 |
| Heavy Atoms | 16 |
| Complexity | 424.20844 |
Chemical Identifiers
| CAS Number | 74695-30-0 |
|---|---|
| SMILES | CC(=O)CC(=O)NC1=C(SC=C1)C(=O)OC |
Product Overview
Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate (CAS 74695-30-0), with molecular formula C10H11NO4S and molecular weight 241.04 g/mol. IUPAC: methyl 3-(3-oxobutanoylamino)thiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate
Property Insights of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate
The XLogP value of 1.4523 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate has 1 hydrogen bond donor(s) and 5 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 3-(3-oxobutanamido)thiophene-2-carboxylate?
The CAS number of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate is 74695-30-0.
What is the molecular formula of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate?
The molecular formula of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate is C10H11NO4S.
What is the molecular weight of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate?
The molecular weight of Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate is 241.04 g/mol.
Where can I buy Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate?
You can request a quote for Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(3-oxobutanamido)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.