BRD-A80770772-001-01-2
TL;DR: BRD-A80770772-001-01-2 (CAS 1024281-09-1) is a chemical compound with molecular formula C29H23ClN6O4S and molecular weight 586.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-[(2-methoxyphenyl)methyl]acetamide
Also Known As: BRD-A80770772-001-01-2, 2-[5-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-[(2-methoxyphenyl)methyl]acetamide, 2-{5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-2-yl}-N-[(2-methoxyphenyl)methyl]acetamide, F6548-4042, 2-(5-(((7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)thio)-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-2-yl)-N-(2-methoxybenzyl)acetamide
| Molecular Formula | C29H23ClN6O4S |
|---|---|
| Molecular Weight | 586.12 g/mol |
| LogP | 3.9549 |
| Topological Polar Surface Area | 117.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 586.119 |
| Heavy Atoms | 41 |
| Complexity | 1820.8353 |
Chemical Identifiers
| CAS Number | 1024281-09-1 |
|---|---|
| SMILES | COC1=CC=CC=C1CNC(=O)CC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC5=CC(=O)N6C=C(C=CC6=N5)Cl |
Product Overview
BRD-A80770772-001-01-2 (CAS 1024281-09-1), with molecular formula C29H23ClN6O4S and molecular weight 586.12 g/mol. IUPAC: 2-[5-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-[(2-methoxyphenyl)methyl]acetamide.
Chemical Property Profile of BRD-A80770772-001-01-2
Property Insights of BRD-A80770772-001-01-2
The XLogP value of 3.9549 indicates that BRD-A80770772-001-01-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A80770772-001-01-2. Following Lipinski's Rule of Five, BRD-A80770772-001-01-2 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRD-A80770772-001-01-2?
The CAS number of BRD-A80770772-001-01-2 is 1024281-09-1.
What is the molecular formula of BRD-A80770772-001-01-2?
The molecular formula of BRD-A80770772-001-01-2 is C29H23ClN6O4S.
What is the molecular weight of BRD-A80770772-001-01-2?
The molecular weight of BRD-A80770772-001-01-2 is 586.12 g/mol.
Where can I buy BRD-A80770772-001-01-2?
You can request a quote for BRD-A80770772-001-01-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-A80770772-001-01-2?
Yes, KEHONG BIO provides custom synthesis services for BRD-A80770772-001-01-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.