F0863-0043
TL;DR: F0863-0043 (CAS 315677-71-5) is a chemical compound with molecular formula C22H21N3O6S and molecular weight 455.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(3-hydroxypropylamino)-3-nitrobenzoyl]amino]-4-phenylthiophene-3-carboxylate
Also Known As: F0863-0043, methyl 2-(4-((3-hydroxypropyl)amino)-3-nitrobenzamido)-4-phenylthiophene-3-carboxylate, methyl 2-{4-[(3-hydroxypropyl)amino]-3-nitrobenzamido}-4-phenylthiophene-3-carboxylate, methyl 2-[[4-(3-hydroxypropylamino)-3-nitrobenzoyl]amino]-4-phenylthiophene-3-carboxylate, Methyl 2-[[4-(3-hydroxypropylamino)-3-nitro-benzoyl]amino]-4-phenyl-thiophene-3-carboxylate
| Molecular Formula | C22H21N3O6S |
|---|---|
| Molecular Weight | 455.12 g/mol |
| LogP | 4.1565 |
| Topological Polar Surface Area | 130.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 455.1151 |
| Heavy Atoms | 32 |
| Complexity | 1129.9497 |
Chemical Identifiers
| CAS Number | 315677-71-5 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)NCCCO)[N+](=O)[O-] |
Product Overview
F0863-0043 (CAS 315677-71-5), with molecular formula C22H21N3O6S and molecular weight 455.12 g/mol. IUPAC: methyl 2-[[4-(3-hydroxypropylamino)-3-nitrobenzoyl]amino]-4-phenylthiophene-3-carboxylate.
Chemical Property Profile of F0863-0043
Property Insights of F0863-0043
The XLogP value of 4.1565 indicates that F0863-0043 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0863-0043. Following Lipinski's Rule of Five, F0863-0043 has 3 hydrogen bond donor(s) and 8 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 F0863-0043?
The CAS number of F0863-0043 is 315677-71-5.
What is the molecular formula of F0863-0043?
The molecular formula of F0863-0043 is C22H21N3O6S.
What is the molecular weight of F0863-0043?
The molecular weight of F0863-0043 is 455.12 g/mol.
Where can I buy F0863-0043?
You can request a quote for F0863-0043 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0863-0043?
Yes, KEHONG BIO provides custom synthesis services for F0863-0043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.