BRD-A04087294-001-01-3
TL;DR: BRD-A04087294-001-01-3 (CAS 1044266-44-5) is a chemical compound with molecular formula C25H27ClN6O2S and molecular weight 510.16046 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide
Also Known As: BRD-A04087294-001-01-3, F6548-3629, N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-3-{3-oxo-5-sulfanylidene-2H,3H,5H,6H-imidazo[1,2-c]quinazolin-2-yl}propanamide, N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-(3-oxo-5-sulfanylidene-1,2-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide, N-[2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl]-3-(3-oxo-5-sulfanylidene-2,6-dihydroimidazo[1,2-c]quinazolin-2-yl)propanamide
Technical Specifications
| Molecular Formula | C25H27ClN6O2S |
| Molecular Weight | 510.16046 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 510.16046 Da |
| Heavy Atoms | 35 |
| Complexity | 1000.0 |
| SMILES | C1CN(CCN1CCNC(=O)CCC2C(=O)N3C(=C4C=CC=CC4=NC3=S)N2)C5=CC(=CC=C5)Cl |
| InChIKey | BCVNDOQCNLQBMK-UHFFFAOYSA-N |
Chemical Property Profile of BRD-A04087294-001-01-3
Property Insights of BRD-A04087294-001-01-3
The XLogP value of 3.1 indicates that BRD-A04087294-001-01-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A04087294-001-01-3. Following Lipinski's Rule of Five, BRD-A04087294-001-01-3 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BRD-A04087294-001-01-3?
The CAS number of BRD-A04087294-001-01-3 is 1044266-44-5.
What is the molecular formula of BRD-A04087294-001-01-3?
The molecular formula of BRD-A04087294-001-01-3 is C25H27ClN6O2S.
What is the molecular weight of BRD-A04087294-001-01-3?
The molecular weight of BRD-A04087294-001-01-3 is 510.16046 g/mol.
Where can I buy BRD-A04087294-001-01-3?
You can request a quote for BRD-A04087294-001-01-3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BRD-A04087294-001-01-3?
Yes, CoreyChem provides custom synthesis services for BRD-A04087294-001-01-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.