A2554/0108781
TL;DR: A2554/0108781 (CAS 299453-92-2) is a chemical compound with molecular formula C28H25NO3 and molecular weight 423.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-methyl-4-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A2554/0108781, benzyl 2-methyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, benzyl 2-methyl-4-(1-naphthyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, benzyl 2-methyl-4-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C28H25NO3 |
|---|---|
| Molecular Weight | 423.18 g/mol |
| LogP | 5.5511 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.18344 |
| Heavy Atoms | 32 |
| Complexity | 1264.8418 |
Chemical Identifiers
| CAS Number | 299453-92-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5 |
Product Overview
A2554/0108781 (CAS 299453-92-2), with molecular formula C28H25NO3 and molecular weight 423.18 g/mol. IUPAC: benzyl 2-methyl-4-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A2554/0108781
Property Insights of A2554/0108781
The XLogP value of 5.5511 indicates that A2554/0108781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, A2554/0108781 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2554/0108781 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2554/0108781?
The CAS number of A2554/0108781 is 299453-92-2.
What is the molecular formula of A2554/0108781?
The molecular formula of A2554/0108781 is C28H25NO3.
What is the molecular weight of A2554/0108781?
The molecular weight of A2554/0108781 is 423.18 g/mol.
Where can I buy A2554/0108781?
You can request a quote for A2554/0108781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2554/0108781?
Yes, KEHONG BIO provides custom synthesis services for A2554/0108781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.