![4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 structure](/static/products/3710/37106-97-1.webp)
4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸
TL;DR: 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 (CAS 37106-97-1) is a chemical compound with molecular formula C23H20N2O5 and molecular weight 404.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸
4-[[2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic acid
Also Known As: bentiromide, Btpaba, Chymex, BZ-TYR-4-ABZ-OH, Bentiromidum [INN-Latin]
| Molecular Formula | C23H20N2O5 |
|---|---|
| Molecular Weight | 404.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 404.1372 |
| Heavy Atoms | 30 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 37106-97-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC3=CC=C(C=C3)C(=O)O |
| InChIKey | SPPTWHFVYKCNNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 (CAS 37106-97-1), with molecular formula C23H20N2O5 and molecular weight 404.14 g/mol. IUPAC: 4-[[2-benzamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic acid.
Chemical Property Profile of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸
Property Insights of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸
The XLogP value of 3.3 indicates that 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸. Following Lipinski's Rule of Five, 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 has 4 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 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸?
The CAS number of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 is 37106-97-1.
What is the molecular formula of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸?
The molecular formula of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 is C23H20N2O5.
What is the molecular weight of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸?
The molecular weight of 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 is 404.14 g/mol.
Where can I buy 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸?
You can request a quote for 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-{[2-(苯甲酰氨基)-3-(4-羟苯基)-1-氧代丙基]氨基}苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.