BAS 00917967
TL;DR: BAS 00917967 (CAS 354760-98-8) is a chemical compound with molecular formula C24H18ClN3O6 and molecular weight 479.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5-(4-methoxyphenyl)-3-(3-nitrophenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: BAS 00917967, 2-(4-chlorophenyl)-5-(4-methoxyphenyl)-3-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, AB00095504-01, AE-641/11950043, F0200-0027
| Molecular Formula | C24H18ClN3O6 |
|---|---|
| Molecular Weight | 479.09 g/mol |
| LogP | 4.3079 |
| Topological Polar Surface Area | 102.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 479.0884 |
| Heavy Atoms | 34 |
| Complexity | 1280.6256 |
Chemical Identifiers
| CAS Number | 354760-98-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=CC(=CC=C5)[N+](=O)[O-] |
Product Overview
BAS 00917967 (CAS 354760-98-8), with molecular formula C24H18ClN3O6 and molecular weight 479.09 g/mol. IUPAC: 2-(4-chlorophenyl)-5-(4-methoxyphenyl)-3-(3-nitrophenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of BAS 00917967
Property Insights of BAS 00917967
The XLogP value of 4.3079 indicates that BAS 00917967 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00917967. Following Lipinski's Rule of Five, BAS 00917967 has 0 hydrogen bond donor(s) and 7 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 00917967?
The CAS number of BAS 00917967 is 354760-98-8.
What is the molecular formula of BAS 00917967?
The molecular formula of BAS 00917967 is C24H18ClN3O6.
What is the molecular weight of BAS 00917967?
The molecular weight of BAS 00917967 is 479.09 g/mol.
Where can I buy BAS 00917967?
You can request a quote for BAS 00917967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00917967?
Yes, KEHONG BIO provides custom synthesis services for BAS 00917967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.