RefChem:327325
TL;DR: RefChem:327325 (CAS 88351-77-3) is a chemical compound with molecular formula C24H23N3O6 and molecular weight 449.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[3-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoyl]amino]benzoate;hydrate
Also Known As: Benzoic acid, 4-((4-(((2-oxo-3(2H)-benzoxazolyl)methyl)amino)benzoyl)amino)-, ethyl ester, hydrate, 4-((4-(((2-Oxo-3(2H)-benzoxazolyl)methyl)amino)benzoyl)amino)benzoic acid ethyl ester hydrate, ETHYL4-[[3-[(2-OXO-1,3-BENZOXAZOL-3-YL)METHYLAMINO]BENZOYL]AMINO]BENZOATEHYDRATE, Ethyl 4-(3-{[(2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]amino}benzamido)benzoate--water (1/1), ethyl 4-[[3-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoyl]amino]benzoate hydrate
| Molecular Formula | C24H23N3O6 |
|---|---|
| Molecular Weight | 449.16 g/mol |
| LogP | 3.27 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 449.1587 |
| Heavy Atoms | 33 |
| Complexity | 679.0 |
Chemical Identifiers
| CAS Number | 88351-77-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NCN3C4=CC=CC=C4OC3=O.O |
| InChIKey | XGSQOXKMTIEZNV-UHFFFAOYSA-N |
Product Overview
RefChem:327325 (CAS 88351-77-3), with molecular formula C24H23N3O6 and molecular weight 449.16 g/mol. IUPAC: ethyl 4-[[3-[(2-oxo-1,3-benzoxazol-3-yl)methylamino]benzoyl]amino]benzoate;hydrate.
Chemical Property Profile of RefChem:327325
Property Insights of RefChem:327325
The XLogP value of 3.27 indicates that RefChem:327325 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:327325. Following Lipinski's Rule of Five, RefChem:327325 has 3 hydrogen bond donor(s) and 7 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 RefChem:327325?
The CAS number of RefChem:327325 is 88351-77-3.
What is the molecular formula of RefChem:327325?
The molecular formula of RefChem:327325 is C24H23N3O6.
What is the molecular weight of RefChem:327325?
The molecular weight of RefChem:327325 is 449.16 g/mol.
Where can I buy RefChem:327325?
You can request a quote for RefChem:327325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327325?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.