F0180-0171
TL;DR: F0180-0171 (CAS 328038-36-4) is a chemical compound with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: F0180-0171, F0789-0032, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-(3-CYANO-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL)-4-(PYRROLIDINE-1-SULFONYL)BENZAMIDE
| Molecular Formula | C20H21N3O3S2 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 3.53538 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.10245 |
| Heavy Atoms | 28 |
| Complexity | 1043.6005 |
Chemical Identifiers
| CAS Number | 328038-36-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C#N |
Product Overview
F0180-0171 (CAS 328038-36-4), with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0180-0171
Property Insights of F0180-0171
The XLogP value of 3.53538 indicates that F0180-0171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F0180-0171. Following Lipinski's Rule of Five, F0180-0171 has 1 hydrogen bond donor(s) and 5 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 F0180-0171?
The CAS number of F0180-0171 is 328038-36-4.
What is the molecular formula of F0180-0171?
The molecular formula of F0180-0171 is C20H21N3O3S2.
What is the molecular weight of F0180-0171?
The molecular weight of F0180-0171 is 415.10 g/mol.
Where can I buy F0180-0171?
You can request a quote for F0180-0171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0180-0171?
Yes, KEHONG BIO provides custom synthesis services for F0180-0171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.