BAS 00917968
TL;DR: BAS 00917968 (CAS 473443-33-3) is a chemical compound with molecular formula C23H15Cl3N2O3 and molecular weight 472.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: BAS 00917968, AE-641/11950431, 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-5-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione, 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-5-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
| Molecular Formula | C23H15Cl3N2O3 |
|---|---|
| Molecular Weight | 472.01 g/mol |
| LogP | 5.6979 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 472.01483 |
| Heavy Atoms | 31 |
| Complexity | 1170.4441 |
Chemical Identifiers
| CAS Number | 473443-33-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl |
Product Overview
BAS 00917968 (CAS 473443-33-3), with molecular formula C23H15Cl3N2O3 and molecular weight 472.01 g/mol. IUPAC: 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of BAS 00917968
Property Insights of BAS 00917968
The XLogP value of 5.6979 indicates that BAS 00917968 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, BAS 00917968 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00917968 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00917968?
The CAS number of BAS 00917968 is 473443-33-3.
What is the molecular formula of BAS 00917968?
The molecular formula of BAS 00917968 is C23H15Cl3N2O3.
What is the molecular weight of BAS 00917968?
The molecular weight of BAS 00917968 is 472.01 g/mol.
Where can I buy BAS 00917968?
You can request a quote for BAS 00917968 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00917968?
Yes, KEHONG BIO provides custom synthesis services for BAS 00917968 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.