AB00102994-01
TL;DR: AB00102994-01 (CAS 355411-93-7) is a chemical compound with molecular formula C22H20ClN3O3S and molecular weight 441.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-N-[(4-morpholin-4-ylphenyl)carbamothioyl]furan-2-carboxamide
Also Known As: AB00102994-01, 5-(4-chlorophenyl)-N-{[4-(morpholin-4-yl)phenyl]carbamothioyl}furan-2-carboxamide, 5-(4-chlorophenyl)-N-[(4-morpholin-4-ylphenyl)carbamothioyl]furan-2-carboxamide, 5-(4-chlorophenyl)-N-((4-morpholinophenyl)carbamothioyl)furan-2-carboxamide, [5-(4-chlorophenyl)(2-furyl)]-N-{[(4-morpholin-4-ylphenyl)amino]thioxomethyl}c arboxamide
| Molecular Formula | C22H20ClN3O3S |
|---|---|
| Molecular Weight | 441.09 g/mol |
| LogP | 4.5634 |
| Topological Polar Surface Area | 66.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 441.0914 |
| Heavy Atoms | 30 |
| Complexity | 1028.5411 |
Chemical Identifiers
| CAS Number | 355411-93-7 |
|---|---|
| SMILES | C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Cl |
Product Overview
AB00102994-01 (CAS 355411-93-7), with molecular formula C22H20ClN3O3S and molecular weight 441.09 g/mol. IUPAC: 5-(4-chlorophenyl)-N-[(4-morpholin-4-ylphenyl)carbamothioyl]furan-2-carboxamide.
Chemical Property Profile of AB00102994-01
Property Insights of AB00102994-01
The XLogP value of 4.5634 indicates that AB00102994-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.74 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00102994-01. Following Lipinski's Rule of Five, AB00102994-01 has 2 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 AB00102994-01?
The CAS number of AB00102994-01 is 355411-93-7.
What is the molecular formula of AB00102994-01?
The molecular formula of AB00102994-01 is C22H20ClN3O3S.
What is the molecular weight of AB00102994-01?
The molecular weight of AB00102994-01 is 441.09 g/mol.
Where can I buy AB00102994-01?
You can request a quote for AB00102994-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00102994-01?
Yes, KEHONG BIO provides custom synthesis services for AB00102994-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.