AP-970/42777138
TL;DR: AP-970/42777138 (CAS 708287-89-2) is a chemical compound with molecular formula C21H17Cl2N3O5S and molecular weight 493.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(3,5-dichloro-2-methoxybenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide
Also Known As: AP-970/42777138, N-[3-[(3,5-dichloro-2-methoxybenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide, N-[3-({[(3,5-dichloro-2-methoxybenzoyl)amino]carbothioyl}amino)-4-methoxyphenyl]-2-furamide, N-[3-({[(3,5-dichloro-2-methoxyphenyl)carbonyl]carbamothioyl}amino)-4-methoxyphenyl]furan-2-carboxamide
| Molecular Formula | C21H17Cl2N3O5S |
|---|---|
| Molecular Weight | 493.03 g/mol |
| LogP | 4.9827 |
| Topological Polar Surface Area | 101.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.0266 |
| Heavy Atoms | 32 |
| Complexity | 1168.4918 |
Chemical Identifiers
| CAS Number | 708287-89-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=S)NC(=O)C3=C(C(=CC(=C3)Cl)Cl)OC |
Product Overview
AP-970/42777138 (CAS 708287-89-2), with molecular formula C21H17Cl2N3O5S and molecular weight 493.03 g/mol. IUPAC: N-[3-[(3,5-dichloro-2-methoxybenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide.
Chemical Property Profile of AP-970/42777138
Property Insights of AP-970/42777138
The XLogP value of 4.9827 indicates that AP-970/42777138 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.83 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42777138. Following Lipinski's Rule of Five, AP-970/42777138 has 3 hydrogen bond donor(s) and 6 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 AP-970/42777138?
The CAS number of AP-970/42777138 is 708287-89-2.
What is the molecular formula of AP-970/42777138?
The molecular formula of AP-970/42777138 is C21H17Cl2N3O5S.
What is the molecular weight of AP-970/42777138?
The molecular weight of AP-970/42777138 is 493.03 g/mol.
Where can I buy AP-970/42777138?
You can request a quote for AP-970/42777138 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42777138?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42777138 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.