AP-970/43373990
TL;DR: AP-970/43373990 (CAS 895640-02-5) is a chemical compound with molecular formula C16H11BrF2N2O3S and molecular weight 427.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-bromo-4,6-difluorophenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Also Known As: AP-970/43373990, N-[(2-bromo-4,6-difluorophenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide, N-(2-bromo-4,6-difluorophenyl)-N'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)thiourea, N-{[(2-bromo-4,6-difluorophenyl)amino]carbonothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
| Molecular Formula | C16H11BrF2N2O3S |
|---|---|
| Molecular Weight | 427.96 g/mol |
| LogP | 3.6253 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 427.96417 |
| Heavy Atoms | 25 |
| Complexity | 840.26373 |
Chemical Identifiers
| CAS Number | 895640-02-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=C(C=C(C=C3Br)F)F |
Product Overview
AP-970/43373990 (CAS 895640-02-5), with molecular formula C16H11BrF2N2O3S and molecular weight 427.96 g/mol. IUPAC: N-[(2-bromo-4,6-difluorophenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide.
Chemical Property Profile of AP-970/43373990
Property Insights of AP-970/43373990
The XLogP value of 3.6253 indicates that AP-970/43373990 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, AP-970/43373990 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AP-970/43373990 has 2 hydrogen bond donor(s) and 4 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-970/43373990?
The CAS number of AP-970/43373990 is 895640-02-5.
What is the molecular formula of AP-970/43373990?
The molecular formula of AP-970/43373990 is C16H11BrF2N2O3S.
What is the molecular weight of AP-970/43373990?
The molecular weight of AP-970/43373990 is 427.96 g/mol.
Where can I buy AP-970/43373990?
You can request a quote for AP-970/43373990 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/43373990?
Yes, KEHONG BIO provides custom synthesis services for AP-970/43373990 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.