ChemDiv2_001238
TL;DR: ChemDiv2_001238 (CAS 491869-71-7) is a chemical compound with molecular formula C24H25N3O7S and molecular weight 499.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-(furan-2-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Also Known As: ChemDiv2_001238, AP-064/40657123, ethyl 3-[(2,5-dimethoxyanilino)carbonyl]-2-(2-furoylamino)-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate, ethyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-(furan-2-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate, ethyl 3-((2,5-dimethoxyphenyl)carbamoyl)-2-(furan-2-carboxamido)-4,5-dihydrothieno[2,3-c]pyridine-6(7H)-carboxylate
| Molecular Formula | C24H25N3O7S |
|---|---|
| Molecular Weight | 499.14 g/mol |
| LogP | 4.3775 |
| Topological Polar Surface Area | 119.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.14133 |
| Heavy Atoms | 35 |
| Complexity | 1236.2261 |
Chemical Identifiers
| CAS Number | 491869-71-7 |
|---|---|
| SMILES | CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=CC(=C3)OC)OC)NC(=O)C4=CC=CO4 |
Product Overview
ChemDiv2_001238 (CAS 491869-71-7), with molecular formula C24H25N3O7S and molecular weight 499.14 g/mol. IUPAC: ethyl 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-(furan-2-carbonylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate.
Chemical Property Profile of ChemDiv2_001238
Property Insights of ChemDiv2_001238
The XLogP value of 4.3775 indicates that ChemDiv2_001238 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.34 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_001238. Following Lipinski's Rule of Five, ChemDiv2_001238 has 2 hydrogen bond donor(s) and 8 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 ChemDiv2_001238?
The CAS number of ChemDiv2_001238 is 491869-71-7.
What is the molecular formula of ChemDiv2_001238?
The molecular formula of ChemDiv2_001238 is C24H25N3O7S.
What is the molecular weight of ChemDiv2_001238?
The molecular weight of ChemDiv2_001238 is 499.14 g/mol.
Where can I buy ChemDiv2_001238?
You can request a quote for ChemDiv2_001238 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001238?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001238 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.