F0018-0578
TL;DR: F0018-0578 (CAS 391219-00-4) is a chemical compound with molecular formula C22H15BrN4O6 and molecular weight 510.0175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-bromo-4-(2,4-dinitrobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
Also Known As: F0018-0578, F1596-0020, 7-bromo-4-(2,4-dinitrobenzoyl)-5-phenyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-one, 7-bromo-4-(2,4-dinitrobenzoyl)-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one, 7-bromo-4-(2,4-dinitrobenzoyl)-5-phenyl-4,5-dihydro-1H-benzo[e][1,4]diazepin-2(3H)-one
Technical Specifications
| Molecular Formula | C22H15BrN4O6 |
| Molecular Weight | 510.0175 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 510.0175 Da |
| Heavy Atoms | 33 |
| Complexity | 780.0 |
| SMILES | C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4 |
| InChIKey | YXVBVJAFHVWJFZ-UHFFFAOYSA-N |
Chemical Property Profile of F0018-0578
Property Insights of F0018-0578
The XLogP value of 3.9 indicates that F0018-0578 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting F0018-0578 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0018-0578 has 1 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 F0018-0578?
The CAS number of F0018-0578 is 391219-00-4.
What is the molecular formula of F0018-0578?
The molecular formula of F0018-0578 is C22H15BrN4O6.
What is the molecular weight of F0018-0578?
The molecular weight of F0018-0578 is 510.0175 g/mol.
Where can I buy F0018-0578?
You can request a quote for F0018-0578 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F0018-0578?
Yes, CoreyChem provides custom synthesis services for F0018-0578 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.