AB00673671-01
TL;DR: AB00673671-01 (CAS 1005117-60-1) is a chemical compound with molecular formula C23H15ClN4O7 and molecular weight 494.06293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chlorophenyl)-5-(3-nitrophenyl)-3-(4-nitrophenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: AB00673671-01, 2-(4-chlorophenyl)-5-(3-nitrophenyl)-3-(4-nitrophenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, F1248-0032, 2-(4-chlorophenyl)-5-(3-nitrophenyl)-3-(4-nitrophenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 2-(4-chlorophenyl)-5-(3-nitrophenyl)-3-(4-nitrophenyl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Technical Specifications
| Molecular Formula | C23H15ClN4O7 |
| Molecular Weight | 494.06293 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 141.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 494.06293 Da |
| Heavy Atoms | 35 |
| Complexity | 863.0 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)[N+](=O)[O-] |
| InChIKey | NHZSTDKVUILCCA-UHFFFAOYSA-N |
Chemical Property Profile of AB00673671-01
Property Insights of AB00673671-01
The XLogP value of 4.3 indicates that AB00673671-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting AB00673671-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00673671-01 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of AB00673671-01?
The CAS number of AB00673671-01 is 1005117-60-1.
What is the molecular formula of AB00673671-01?
The molecular formula of AB00673671-01 is C23H15ClN4O7.
What is the molecular weight of AB00673671-01?
The molecular weight of AB00673671-01 is 494.06293 g/mol.
Where can I buy AB00673671-01?
You can request a quote for AB00673671-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00673671-01?
Yes, CoreyChem provides custom synthesis services for AB00673671-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.