![methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate structure](/static/products/4449/444909-04-0.webp)
methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate
TL;DR: methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate (CAS 444909-04-0) is a chemical compound with molecular formula C29H24N2O6S and molecular weight 528.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate
Also Known As: methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate, methyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate, methyl 5-((2-methoxyphenyl)carbamoyl)-4-methyl-2-(9H-xanthene-9-carboxamido)thiophene-3-carboxylate, methyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]thiophene-3-carboxylate
| Molecular Formula | C29H24N2O6S |
|---|---|
| Molecular Weight | 528.14 g/mol |
| LogP | 5.98032 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 528.1355 |
| Heavy Atoms | 38 |
| Complexity | 1514.921 |
Chemical Identifiers
| CAS Number | 444909-04-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24)C(=O)NC5=CC=CC=C5OC |
Product Overview
methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate (CAS 444909-04-0), with molecular formula C29H24N2O6S and molecular weight 528.14 g/mol. IUPAC: methyl 5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-(9H-xanthene-9-carbonylamino)thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate
Property Insights of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate
The XLogP value of 5.98032 indicates that methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate. Following Lipinski's Rule of Five, methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate?
The CAS number of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate is 444909-04-0.
What is the molecular formula of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate?
The molecular formula of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate is C29H24N2O6S.
What is the molecular weight of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate?
The molecular weight of methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate is 528.14 g/mol.
Where can I buy methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate?
You can request a quote for methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[(2-methoxyanilino)carbonyl]-4-methyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.