F0016-0475
TL;DR: F0016-0475 (CAS 312917-29-6) is a chemical compound with molecular formula C18H17Cl2NO3S and molecular weight 397.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3,5-dichlorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F0016-0475, ETHYL 2-(3,5-DICHLOROBENZAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-(3,5-dichlorobenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[(3,5-dichlorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H17Cl2NO3S |
|---|---|
| Molecular Weight | 397.03 g/mol |
| LogP | 5.3627 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.0306 |
| Heavy Atoms | 25 |
| Complexity | 811.71893 |
Chemical Identifiers
| CAS Number | 312917-29-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=CC(=C3)Cl)Cl |
Product Overview
F0016-0475 (CAS 312917-29-6), with molecular formula C18H17Cl2NO3S and molecular weight 397.03 g/mol. IUPAC: ethyl 2-[(3,5-dichlorobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F0016-0475
Property Insights of F0016-0475
The XLogP value of 5.3627 indicates that F0016-0475 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, F0016-0475 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0016-0475 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0016-0475?
The CAS number of F0016-0475 is 312917-29-6.
What is the molecular formula of F0016-0475?
The molecular formula of F0016-0475 is C18H17Cl2NO3S.
What is the molecular weight of F0016-0475?
The molecular weight of F0016-0475 is 397.03 g/mol.
Where can I buy F0016-0475?
You can request a quote for F0016-0475 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0016-0475?
Yes, KEHONG BIO provides custom synthesis services for F0016-0475 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.