4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
TL;DR: 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CAS 444933-45-3) is a chemical compound with molecular formula C30H26Br2ClN3O4 and molecular weight 685.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromo-2-pyridinyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
Also Known As: 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide, 4-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide, 4-{3-[(2-BROMO-4-CHLOROPHENOXY)METHYL]-4-METHOXYPHENYL}-N-(5-BROMO-2-PYRIDYL)-2-METHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXAMIDE
| Molecular Formula | C30H26Br2ClN3O4 |
|---|---|
| Molecular Weight | 685.00 g/mol |
| LogP | 7.4542 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 684.99786 |
| Heavy Atoms | 40 |
| Complexity | 1552.9987 |
Chemical Identifiers
| CAS Number | 444933-45-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)OC)COC4=C(C=C(C=C4)Cl)Br)C(=O)NC5=NC=C(C=C5)Br |
Product Overview
4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CAS 444933-45-3), with molecular formula C30H26Br2ClN3O4 and molecular weight 685.00 g/mol. IUPAC: 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromo-2-pyridinyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
Chemical Property Profile of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
Property Insights of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
The XLogP value of 7.4542 indicates that 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide. Following Lipinski's Rule of Five, 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide 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 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The CAS number of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is 444933-45-3.
What is the molecular formula of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The molecular formula of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is C30H26Br2ClN3O4.
What is the molecular weight of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The molecular weight of 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is 685.00 g/mol.
Where can I buy 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
You can request a quote for 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-N-(5-bromopyridin-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.