F0916-3339
TL;DR: F0916-3339 (CAS 459414-89-2) is a chemical compound with molecular formula C23H29NO4S and molecular weight 415.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(4-tert-butylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: F0916-3339, METHYL 2-[4-(4-TERT-BUTYLPHENOXY)BUTANAMIDO]-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE, methyl 2-(4-(4-(tert-butyl)phenoxy)butanamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-[4-(4-tert-butylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-{4-[4-(tert-butyl)phenoxy]butanoylamino}-4,5,6-trihydrocyclopenta[2,1 -b]thiophene-3-carboxylate
| Molecular Formula | C23H29NO4S |
|---|---|
| Molecular Weight | 415.18 g/mol |
| LogP | 5.1186 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.18173 |
| Heavy Atoms | 29 |
| Complexity | 877.5182 |
Chemical Identifiers
| CAS Number | 459414-89-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC |
Product Overview
F0916-3339 (CAS 459414-89-2), with molecular formula C23H29NO4S and molecular weight 415.18 g/mol. IUPAC: methyl 2-[4-(4-tert-butylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0916-3339
Property Insights of F0916-3339
The XLogP value of 5.1186 indicates that F0916-3339 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-3339. Following Lipinski's Rule of Five, F0916-3339 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-3339?
The CAS number of F0916-3339 is 459414-89-2.
What is the molecular formula of F0916-3339?
The molecular formula of F0916-3339 is C23H29NO4S.
What is the molecular weight of F0916-3339?
The molecular weight of F0916-3339 is 415.18 g/mol.
Where can I buy F0916-3339?
You can request a quote for F0916-3339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-3339?
Yes, KEHONG BIO provides custom synthesis services for F0916-3339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.