F0817-0338
TL;DR: F0817-0338 (CAS 420090-13-7) is a chemical compound with molecular formula C19H20N2O5S and molecular weight 388.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-nitrobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: F0817-0338, ethyl 2-(3-nitrobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ETHYL 2-(3-NITROBENZAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXYLATE, ethyl 2-[(3-nitrobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-[(3-nitrophenyl)carbonylamino]-4,5,6,7,8-pentahydrocyclohepta[2,1-b]th iophene-3-carboxylate
| Molecular Formula | C19H20N2O5S |
|---|---|
| Molecular Weight | 388.11 g/mol |
| LogP | 4.3542 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.10928 |
| Heavy Atoms | 27 |
| Complexity | 890.22034 |
Chemical Identifiers
| CAS Number | 420090-13-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
F0817-0338 (CAS 420090-13-7), with molecular formula C19H20N2O5S and molecular weight 388.11 g/mol. IUPAC: ethyl 2-[(3-nitrobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0817-0338
Property Insights of F0817-0338
The XLogP value of 4.3542 indicates that F0817-0338 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for F0817-0338. Following Lipinski's Rule of Five, F0817-0338 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 F0817-0338?
The CAS number of F0817-0338 is 420090-13-7.
What is the molecular formula of F0817-0338?
The molecular formula of F0817-0338 is C19H20N2O5S.
What is the molecular weight of F0817-0338?
The molecular weight of F0817-0338 is 388.11 g/mol.
Where can I buy F0817-0338?
You can request a quote for F0817-0338 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0817-0338?
Yes, KEHONG BIO provides custom synthesis services for F0817-0338 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.