F3394-1388
TL;DR: F3394-1388 (CAS 780786-42-7) is a chemical compound with molecular formula C31H22FN3O5S3 and molecular weight 631.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-fluorophenyl)-2-[[2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate
Also Known As: F3394-1388, ethyl 4-(4-fluorophenyl)-2-(2-{[5-(furan-2-yl)-4-oxo-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)thiophene-3-carboxylate, ethyl 4-(4-fluorophenyl)-2-(2-((5-(furan-2-yl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetamido)thiophene-3-carboxylate, ethyl 4-(4-fluorophenyl)-2-[[2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate, ethyl 4-(p-fluorophenyl)-2-({[3-(2-furyl)-4-oxo-5-phenyl-1-thia-5,7-diaza-4,5-dihydro-6-indenylthio]methyl}carbonylamino)-3-thenoate
| Molecular Formula | C31H22FN3O5S3 |
|---|---|
| Molecular Weight | 631.07 g/mol |
| LogP | 7.4823 |
| Topological Polar Surface Area | 103.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 631.07056 |
| Heavy Atoms | 43 |
| Complexity | 1981.2831 |
Chemical Identifiers
| CAS Number | 780786-42-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CSC3=NC4=C(C(=CS4)C5=CC=CO5)C(=O)N3C6=CC=CC=C6 |
Product Overview
F3394-1388 (CAS 780786-42-7), with molecular formula C31H22FN3O5S3 and molecular weight 631.07 g/mol. IUPAC: ethyl 4-(4-fluorophenyl)-2-[[2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F3394-1388
Property Insights of F3394-1388
The XLogP value of 7.4823 indicates that F3394-1388 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.43 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-1388. Following Lipinski's Rule of Five, F3394-1388 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-1388?
The CAS number of F3394-1388 is 780786-42-7.
What is the molecular formula of F3394-1388?
The molecular formula of F3394-1388 is C31H22FN3O5S3.
What is the molecular weight of F3394-1388?
The molecular weight of F3394-1388 is 631.07 g/mol.
Where can I buy F3394-1388?
You can request a quote for F3394-1388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-1388?
Yes, KEHONG BIO provides custom synthesis services for F3394-1388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.