F1174-3002
TL;DR: F1174-3002 (CAS 379236-31-4) is a chemical compound with molecular formula C24H23N3O4S3 and molecular weight 513.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(5-methylfuran-2-yl)-2-[[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
Also Known As: F1174-3002, AF-399/40756882, ethyl 4-(5-methylfuran-2-yl)-2-[[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate, ethyl 4-(5-methylfuran-2-yl)-2-(2-{8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-ylsulfanyl}acetamido)thiophene-3-carboxylate, ethyl 4-(5-methyl-2-furyl)-2-{[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)acetyl]amino}-3-thiophenecarboxylate
| Molecular Formula | C24H23N3O4S3 |
|---|---|
| Molecular Weight | 513.09 g/mol |
| LogP | 6.10752 |
| Topological Polar Surface Area | 94.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.0851 |
| Heavy Atoms | 34 |
| Complexity | 1371.2189 |
Chemical Identifiers
| CAS Number | 379236-31-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(O2)C)NC(=O)CSC3=NC=NC4=C3C5=C(S4)CCCC5 |
Product Overview
F1174-3002 (CAS 379236-31-4), with molecular formula C24H23N3O4S3 and molecular weight 513.09 g/mol. IUPAC: ethyl 4-(5-methylfuran-2-yl)-2-[[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F1174-3002
Property Insights of F1174-3002
The XLogP value of 6.10752 indicates that F1174-3002 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.32 Ų falls within the moderate polarity range, balancing permeability and solubility for F1174-3002. Following Lipinski's Rule of Five, F1174-3002 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 F1174-3002?
The CAS number of F1174-3002 is 379236-31-4.
What is the molecular formula of F1174-3002?
The molecular formula of F1174-3002 is C24H23N3O4S3.
What is the molecular weight of F1174-3002?
The molecular weight of F1174-3002 is 513.09 g/mol.
Where can I buy F1174-3002?
You can request a quote for F1174-3002 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1174-3002?
Yes, KEHONG BIO provides custom synthesis services for F1174-3002 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.