![3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester structure](/static/products/5886/588674-68-4.webp)
3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester
TL;DR: 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester (CAS 588674-68-4) is a chemical compound with molecular formula C22H17NO4S and molecular weight 391.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3-methyl-1-benzofuran-2-carbonyl)amino]-5-phenylthiophene-3-carboxylate
Also Known As: 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester, 3-Thiophenecarboxylicacid,2-[[ carbonyl]amino]-5-phenyl-,methylester, 3-Thiophenecarboxylicacid,2-[[(3-methyl-2-benzofuranyl)carbonyl]amino]-5-phenyl-,methylester(9ci), methyl 2-[(3-methyl-1-benzofuran-2-carbonyl)amino]-5-phenylthiophene-3-carboxylate, methyl 2-[(3-methylbenzo[d]furan-2-yl)carbonylamino]-5-phenylthiophene-3-carbo xylate
| Molecular Formula | C22H17NO4S |
|---|---|
| Molecular Weight | 391.09 g/mol |
| LogP | 5.50862 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.08783 |
| Heavy Atoms | 28 |
| Complexity | 1173.9502 |
Chemical Identifiers
| CAS Number | 588674-68-4 |
|---|---|
| SMILES | CC1=C(OC2=CC=CC=C12)C(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC |
Product Overview
3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester (CAS 588674-68-4), with molecular formula C22H17NO4S and molecular weight 391.09 g/mol. IUPAC: methyl 2-[(3-methyl-1-benzofuran-2-carbonyl)amino]-5-phenylthiophene-3-carboxylate.
Chemical Property Profile of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester
Property Insights of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester
The XLogP value of 5.50862 indicates that 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester. Following Lipinski's Rule of Five, 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester?
The CAS number of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester is 588674-68-4.
What is the molecular formula of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester?
The molecular formula of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester is C22H17NO4S.
What is the molecular weight of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester?
The molecular weight of 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester is 391.09 g/mol.
Where can I buy 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester?
You can request a quote for 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester?
Yes, KEHONG BIO provides custom synthesis services for 3-thiophenecarboxylicacid,2-[[carbonyl]amino]-5-phenyl-,methylester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.