BAS 02768425
TL;DR: BAS 02768425 (CAS 494196-69-9) is a chemical compound with molecular formula C27H27BrN2O5 and molecular weight 538.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-bromo-1,3-benzodioxol-5-yl)-N-(2-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
Also Known As: BAS 02768425, 4-(6-Bromobenzo[d][1,3]dioxol-5-yl)-N-(2-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide, 4-(6-bromo-1,3-benzodioxol-5-yl)-N-(2-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide, [4-(6-bromo(2H-benzo[d]1,3-dioxolan-5-yl))-2,7,7-trimethyl-5-oxo(3-1,4,6,7,8-p entahydroquinolyl)]-N-(2-methoxyphenyl)carboxamide, 4-(6-bromo-1,3-benzodioxol-5-yl)-N-(2-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
| Molecular Formula | C27H27BrN2O5 |
|---|---|
| Molecular Weight | 538.11 g/mol |
| LogP | 5.4291 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 538.11035 |
| Heavy Atoms | 35 |
| Complexity | 1310.645 |
Chemical Identifiers
| CAS Number | 494196-69-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC4=C(C=C3Br)OCO4)C(=O)NC5=CC=CC=C5OC |
Product Overview
BAS 02768425 (CAS 494196-69-9), with molecular formula C27H27BrN2O5 and molecular weight 538.11 g/mol. IUPAC: 4-(6-bromo-1,3-benzodioxol-5-yl)-N-(2-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide.
Chemical Property Profile of BAS 02768425
Property Insights of BAS 02768425
The XLogP value of 5.4291 indicates that BAS 02768425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02768425. Following Lipinski's Rule of Five, BAS 02768425 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02768425?
The CAS number of BAS 02768425 is 494196-69-9.
What is the molecular formula of BAS 02768425?
The molecular formula of BAS 02768425 is C27H27BrN2O5.
What is the molecular weight of BAS 02768425?
The molecular weight of BAS 02768425 is 538.11 g/mol.
Where can I buy BAS 02768425?
You can request a quote for BAS 02768425 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02768425?
Yes, KEHONG BIO provides custom synthesis services for BAS 02768425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.