BAS 00410597
TL;DR: BAS 00410597 (CAS 299945-67-8) is a chemical compound with molecular formula C26H35NO4 and molecular weight 425.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00410597, pentyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, pentyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, pentyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, 4-(2-Butoxy-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic
| Molecular Formula | C26H35NO4 |
|---|---|
| Molecular Weight | 425.26 g/mol |
| LogP | 5.5668 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 425.25662 |
| Heavy Atoms | 31 |
| Complexity | 867.91284 |
Chemical Identifiers
| CAS Number | 299945-67-8 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OCCCC)C(=O)CCC2)C |
Product Overview
BAS 00410597 (CAS 299945-67-8), with molecular formula C26H35NO4 and molecular weight 425.26 g/mol. IUPAC: pentyl 4-(2-butoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00410597
Property Insights of BAS 00410597
The XLogP value of 5.5668 indicates that BAS 00410597 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00410597. Following Lipinski's Rule of Five, BAS 00410597 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00410597?
The CAS number of BAS 00410597 is 299945-67-8.
What is the molecular formula of BAS 00410597?
The molecular formula of BAS 00410597 is C26H35NO4.
What is the molecular weight of BAS 00410597?
The molecular weight of BAS 00410597 is 425.26 g/mol.
Where can I buy BAS 00410597?
You can request a quote for BAS 00410597 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410597?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410597 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.