URB754
TL;DR: URB754 (CAS 86672-58-4) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
URB754
6-methyl-2-(4-methylanilino)-3,1-benzoxazin-4-one
Also Known As: 6-Methyl-2-(p-tolylamino)-4H-benzo[d][1,3]oxazin-4-one, 6-Methyl-2-(p-tolylamino)-4H-3,1-benzoxazin-4-one, URB754,URB-754/, 6-methyl-2-(4-methylanilino)-3,1-benzoxazin-4-one, 6-Methyl-2-[(4-methylphenyl)amino]-4H-3,1-benzoxazin-4-one
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 3.54844 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 819.99475 |
Chemical Identifiers
| CAS Number | 86672-58-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)C)C(=O)O2 |
Product Overview
URB754 (CAS 86672-58-4), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 6-methyl-2-(4-methylanilino)-3,1-benzoxazin-4-one.
Chemical Property Profile of URB754
Property Insights of URB754
The XLogP value of 3.54844 indicates that URB754 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, URB754 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, URB754 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 URB754?
The CAS number of URB754 is 86672-58-4.
What is the molecular formula of URB754?
The molecular formula of URB754 is C16H14N2O2.
What is the molecular weight of URB754?
The molecular weight of URB754 is 266.11 g/mol.
Where can I buy URB754?
You can request a quote for URB754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for URB754?
Yes, KEHONG BIO provides custom synthesis services for URB754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.