AB00100875-01
TL;DR: AB00100875-01 (CAS 329694-75-9) is a chemical compound with molecular formula C25H19BrN2O3 and molecular weight 474.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: AB00100875-01, F1065-0507, AF-399/37285021, (E)-5-(4-bromophenyl)-2-phenyl-3-styryldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(4-bromophenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C25H19BrN2O3 |
|---|---|
| Molecular Weight | 474.06 g/mol |
| LogP | 4.8409 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 474.05792 |
| Heavy Atoms | 31 |
| Complexity | 1132.4482 |
Chemical Identifiers
| CAS Number | 329694-75-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)ON2C5=CC=CC=C5 |
Product Overview
AB00100875-01 (CAS 329694-75-9), with molecular formula C25H19BrN2O3 and molecular weight 474.06 g/mol. IUPAC: 5-(4-bromophenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of AB00100875-01
Property Insights of AB00100875-01
The XLogP value of 4.8409 indicates that AB00100875-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, AB00100875-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00100875-01 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00100875-01?
The CAS number of AB00100875-01 is 329694-75-9.
What is the molecular formula of AB00100875-01?
The molecular formula of AB00100875-01 is C25H19BrN2O3.
What is the molecular weight of AB00100875-01?
The molecular weight of AB00100875-01 is 474.06 g/mol.
Where can I buy AB00100875-01?
You can request a quote for AB00100875-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00100875-01?
Yes, KEHONG BIO provides custom synthesis services for AB00100875-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.