BAS 03571313
TL;DR: BAS 03571313 (CAS 306969-52-8) is a chemical compound with molecular formula C25H22ClN3O3 and molecular weight 447.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: BAS 03571313, AB00096345-01, 2-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-5-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 2-(4-chlorophenyl)-3-(4-(dimethylamino)phenyl)-5-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, F0220-0004
| Molecular Formula | C25H22ClN3O3 |
|---|---|
| Molecular Weight | 447.13 g/mol |
| LogP | 4.4571 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.13498 |
| Heavy Atoms | 32 |
| Complexity | 1149.3143 |
Chemical Identifiers
| CAS Number | 306969-52-8 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC=C4)ON2C5=CC=C(C=C5)Cl |
Product Overview
BAS 03571313 (CAS 306969-52-8), with molecular formula C25H22ClN3O3 and molecular weight 447.13 g/mol. IUPAC: 2-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of BAS 03571313
Property Insights of BAS 03571313
The XLogP value of 4.4571 indicates that BAS 03571313 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, BAS 03571313 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 03571313 has 0 hydrogen bond donor(s) and 5 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 BAS 03571313?
The CAS number of BAS 03571313 is 306969-52-8.
What is the molecular formula of BAS 03571313?
The molecular formula of BAS 03571313 is C25H22ClN3O3.
What is the molecular weight of BAS 03571313?
The molecular weight of BAS 03571313 is 447.13 g/mol.
Where can I buy BAS 03571313?
You can request a quote for BAS 03571313 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03571313?
Yes, KEHONG BIO provides custom synthesis services for BAS 03571313 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.