BRD-A31139882-001-01-7
TL;DR: BRD-A31139882-001-01-7 (CAS 1024246-40-9) is a chemical compound with molecular formula C26H18ClN5O2S and molecular weight 499.08698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-5-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-3-one
Also Known As: BRD-A31139882-001-01-7, F0919-6619, 2-benzyl-5-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-2H,3H-imidazo[1,2-c]quinazolin-3-one, 2-benzyl-5-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-2H-imidazo[1,2-c]quinazolin-3-one, 2-benzyl-5-{[(7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]thio}imidazo[1,2-c]quinazolin-3(2H)-one
Technical Specifications
| Molecular Formula | C26H18ClN5O2S |
| Molecular Weight | 499.08698 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 499.08698 Da |
| Heavy Atoms | 35 |
| Complexity | 1120.0 |
| SMILES | C1=CC=C(C=C1)CC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC5=CC(=O)N6C=C(C=CC6=N5)Cl |
| InChIKey | KJXXVJGQEWVSJT-UHFFFAOYSA-N |
Chemical Property Profile of BRD-A31139882-001-01-7
Property Insights of BRD-A31139882-001-01-7
The XLogP value of 3.5 indicates that BRD-A31139882-001-01-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A31139882-001-01-7. Following Lipinski's Rule of Five, BRD-A31139882-001-01-7 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BRD-A31139882-001-01-7?
The CAS number of BRD-A31139882-001-01-7 is 1024246-40-9.
What is the molecular formula of BRD-A31139882-001-01-7?
The molecular formula of BRD-A31139882-001-01-7 is C26H18ClN5O2S.
What is the molecular weight of BRD-A31139882-001-01-7?
The molecular weight of BRD-A31139882-001-01-7 is 499.08698 g/mol.
Where can I buy BRD-A31139882-001-01-7?
You can request a quote for BRD-A31139882-001-01-7 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BRD-A31139882-001-01-7?
Yes, CoreyChem provides custom synthesis services for BRD-A31139882-001-01-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.