4-19-00-03867 (Beilstein Handbook Reference)
TL;DR: 4-19-00-03867 (Beilstein Handbook Reference) (CAS 110357-86-3) is a chemical compound with molecular formula C14H13NO8 and molecular weight 323.06412 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3-carboxy-3-formyloxy-5-oxopentanoyl)amino]benzoic acid
Also Known As: 4-19-00-03867 (Beilstein Handbook Reference), 4-[(3-carboxy-3-formyloxy-5-oxopentanoyl)amino]benzoic acid, 2-(((p-Carboxyphenyl)carbamoyl)methyl)-2-(hydroxymethoxy)succinic acid gamma-lactone, 4-[3-Carboxy-3-(formyloxy)-5-oxopentanamido]benzoic acid, Succinic acid, 2-(((p-carboxyphenyl)carbamoyl)methyl)-2-(hydroxymethoxy)-, gamma-lactone
Technical Specifications
| Molecular Formula | C14H13NO8 |
| Molecular Weight | 323.06412 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 323.06412 Da |
| Heavy Atoms | 23 |
| Complexity | 483.0 |
| SMILES | C1=CC(=CC=C1C(=O)O)NC(=O)CC(CC=O)(C(=O)O)OC=O |
| InChIKey | OOVRYNHDVUOGIE-UHFFFAOYSA-N |
Chemical Property Profile of 4-19-00-03867 (Beilstein Handbook Reference)
Property Insights of 4-19-00-03867 (Beilstein Handbook Reference)
The XLogP value of -0.7 indicates that 4-19-00-03867 (Beilstein Handbook Reference) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting 4-19-00-03867 (Beilstein Handbook Reference) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-19-00-03867 (Beilstein Handbook Reference) has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-19-00-03867 (Beilstein Handbook Reference)?
The CAS number of 4-19-00-03867 (Beilstein Handbook Reference) is 110357-86-3.
What is the molecular formula of 4-19-00-03867 (Beilstein Handbook Reference)?
The molecular formula of 4-19-00-03867 (Beilstein Handbook Reference) is C14H13NO8.
What is the molecular weight of 4-19-00-03867 (Beilstein Handbook Reference)?
The molecular weight of 4-19-00-03867 (Beilstein Handbook Reference) is 323.06412 g/mol.
Where can I buy 4-19-00-03867 (Beilstein Handbook Reference)?
You can request a quote for 4-19-00-03867 (Beilstein Handbook Reference) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-19-00-03867 (Beilstein Handbook Reference)?
Yes, CoreyChem provides custom synthesis services for 4-19-00-03867 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.