F0817-0405
TL;DR: F0817-0405 (CAS 397290-73-2) is a chemical compound with molecular formula C28H30N2O5S2 and molecular weight 538.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: F0817-0405, ethyl 2-[4-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzamido]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-(4-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)benzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C28H30N2O5S2 |
|---|---|
| Molecular Weight | 538.16 g/mol |
| LogP | 5.193 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 538.1596 |
| Heavy Atoms | 37 |
| Complexity | 1427.2493 |
Chemical Identifiers
| CAS Number | 397290-73-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4 |
Product Overview
F0817-0405 (CAS 397290-73-2), with molecular formula C28H30N2O5S2 and molecular weight 538.16 g/mol. IUPAC: ethyl 2-[[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0817-0405
Property Insights of F0817-0405
The XLogP value of 5.193 indicates that F0817-0405 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for F0817-0405. Following Lipinski's Rule of Five, F0817-0405 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0817-0405?
The CAS number of F0817-0405 is 397290-73-2.
What is the molecular formula of F0817-0405?
The molecular formula of F0817-0405 is C28H30N2O5S2.
What is the molecular weight of F0817-0405?
The molecular weight of F0817-0405 is 538.16 g/mol.
Where can I buy F0817-0405?
You can request a quote for F0817-0405 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0817-0405?
Yes, KEHONG BIO provides custom synthesis services for F0817-0405 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.