AB00675648-01
TL;DR: AB00675648-01 (CAS 868145-08-8) is a chemical compound with molecular formula C19H17NO4 and molecular weight 323.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-2-[[4-(dimethylamino)phenyl]methylidene]-3-oxo-1-benzofuran-5-carboxylate
Also Known As: AB00675648-01, F1673-7102, (Z)-methyl 2-(4-(dimethylamino)benzylidene)-3-oxo-2,3-dihydrobenzofuran-5-carboxylate, methyl (2Z)-2-{[4-(dimethylamino)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate, methyl (2Z)-2-[(4-dimethylaminophenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate
| Molecular Formula | C19H17NO4 |
|---|---|
| Molecular Weight | 323.12 g/mol |
| LogP | 3.1554 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.11575 |
| Heavy Atoms | 24 |
| Complexity | 834.9453 |
Chemical Identifiers
| CAS Number | 868145-08-8 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC |
Product Overview
AB00675648-01 (CAS 868145-08-8), with molecular formula C19H17NO4 and molecular weight 323.12 g/mol. IUPAC: methyl (2Z)-2-[[4-(dimethylamino)phenyl]methylidene]-3-oxo-1-benzofuran-5-carboxylate.
Chemical Property Profile of AB00675648-01
Property Insights of AB00675648-01
The XLogP value of 3.1554 indicates that AB00675648-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AB00675648-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00675648-01 has 0 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 AB00675648-01?
The CAS number of AB00675648-01 is 868145-08-8.
What is the molecular formula of AB00675648-01?
The molecular formula of AB00675648-01 is C19H17NO4.
What is the molecular weight of AB00675648-01?
The molecular weight of AB00675648-01 is 323.12 g/mol.
Where can I buy AB00675648-01?
You can request a quote for AB00675648-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00675648-01?
Yes, KEHONG BIO provides custom synthesis services for AB00675648-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.