AB00740789-01
TL;DR: AB00740789-01 (CAS 691371-93-4) is a chemical compound with molecular formula C19H16Cl2N2O3 and molecular weight 390.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-[(4-chlorophenyl)methyl]-4-(2-methoxy-5-methylanilino)pyrrole-2,5-dione
Also Known As: AB00740789-01, 3-Chloro-1-(4-chlorobenzyl)-4-((2-methoxy-5-methylphenyl)amino)-1H-pyrrole-2,5-dione, 3-chloro-1-[(4-chlorophenyl)methyl]-4-(2-methoxy-5-methylanilino)pyrrole-2,5-dione
| Molecular Formula | C19H16Cl2N2O3 |
|---|---|
| Molecular Weight | 390.05 g/mol |
| LogP | 4.08832 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.0538 |
| Heavy Atoms | 26 |
| Complexity | 907.5003 |
Chemical Identifiers
| CAS Number | 691371-93-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)NC2=C(C(=O)N(C2=O)CC3=CC=C(C=C3)Cl)Cl |
Product Overview
AB00740789-01 (CAS 691371-93-4), with molecular formula C19H16Cl2N2O3 and molecular weight 390.05 g/mol. IUPAC: 3-chloro-1-[(4-chlorophenyl)methyl]-4-(2-methoxy-5-methylanilino)pyrrole-2,5-dione.
Chemical Property Profile of AB00740789-01
Property Insights of AB00740789-01
The XLogP value of 4.08832 indicates that AB00740789-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, AB00740789-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00740789-01 has 1 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 AB00740789-01?
The CAS number of AB00740789-01 is 691371-93-4.
What is the molecular formula of AB00740789-01?
The molecular formula of AB00740789-01 is C19H16Cl2N2O3.
What is the molecular weight of AB00740789-01?
The molecular weight of AB00740789-01 is 390.05 g/mol.
Where can I buy AB00740789-01?
You can request a quote for AB00740789-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00740789-01?
Yes, KEHONG BIO provides custom synthesis services for AB00740789-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.