F6548-4045
TL;DR: F6548-4045 (CAS 1023548-02-8) is a chemical compound with molecular formula C31H29N5O6S and molecular weight 599.18384 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,3-benzodioxol-5-yl)-2-[[2-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]butanamide
Also Known As: F6548-4045, N-(1,3-benzodioxol-5-yl)-2-[[2-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]butanamide, N-(2H-1,3-benzodioxol-5-yl)-2-{[2-({[(2-methoxyphenyl)methyl]carbamoyl}methyl)-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl}butanamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((2-(2-((2-methoxybenzyl)amino)-2-oxoethyl)-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)thio)butanamide
Technical Specifications
| Molecular Formula | C31H29N5O6S |
| Molecular Weight | 599.18384 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 599.18384 Da |
| Heavy Atoms | 43 |
| Complexity | 1120.0 |
| SMILES | CCC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC4=CC=CC=C4C5=NC(C(=O)N53)CC(=O)NCC6=CC=CC=C6OC |
| InChIKey | JWJGINQNYPLXNH-UHFFFAOYSA-N |
Chemical Property Profile of F6548-4045
Property Insights of F6548-4045
The XLogP value of 3.9 indicates that F6548-4045 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting F6548-4045 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F6548-4045 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of F6548-4045?
The CAS number of F6548-4045 is 1023548-02-8.
What is the molecular formula of F6548-4045?
The molecular formula of F6548-4045 is C31H29N5O6S.
What is the molecular weight of F6548-4045?
The molecular weight of F6548-4045 is 599.18384 g/mol.
Where can I buy F6548-4045?
You can request a quote for F6548-4045 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F6548-4045?
Yes, CoreyChem provides custom synthesis services for F6548-4045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.