F1787-0247
TL;DR: F1787-0247 (CAS 853890-38-7) is a chemical compound with molecular formula C23H25NO5S and molecular weight 427.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-2-[(7-methyl-1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F1787-0247, ethyl 6-methyl-2-(7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-amido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-methyl-2-[(7-methyl-1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-methyl-2-{[(7-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 6-methyl-2-(7-methyl-1-oxoisochroman-3-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C23H25NO5S |
|---|---|
| Molecular Weight | 427.15 g/mol |
| LogP | 4.07822 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.14536 |
| Heavy Atoms | 30 |
| Complexity | 1024.8411 |
Chemical Identifiers
| CAS Number | 853890-38-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3CC4=C(C=C(C=C4)C)C(=O)O3 |
Product Overview
F1787-0247 (CAS 853890-38-7), with molecular formula C23H25NO5S and molecular weight 427.15 g/mol. IUPAC: ethyl 6-methyl-2-[(7-methyl-1-oxo-3,4-dihydroisochromene-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F1787-0247
Property Insights of F1787-0247
The XLogP value of 4.07822 indicates that F1787-0247 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for F1787-0247. Following Lipinski's Rule of Five, F1787-0247 has 1 hydrogen bond donor(s) and 6 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 F1787-0247?
The CAS number of F1787-0247 is 853890-38-7.
What is the molecular formula of F1787-0247?
The molecular formula of F1787-0247 is C23H25NO5S.
What is the molecular weight of F1787-0247?
The molecular weight of F1787-0247 is 427.15 g/mol.
Where can I buy F1787-0247?
You can request a quote for F1787-0247 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1787-0247?
Yes, KEHONG BIO provides custom synthesis services for F1787-0247 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.