BAS 02916416
TL;DR: BAS 02916416 (CAS 355115-36-5) is a chemical compound with molecular formula C22H17ClN2O3S and molecular weight 424.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5-(4-methylphenyl)-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: BAS 02916416, 2-(4-chlorophenyl)-3-(thiophen-2-yl)-5-(p-tolyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, AB00099732-01, AE-641/12845516, 2-(4-chlorophenyl)-5-(4-methylphenyl)-3-(thiophen-2-yl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C22H17ClN2O3S |
|---|---|
| Molecular Weight | 424.06 g/mol |
| LogP | 4.76102 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 424.06485 |
| Heavy Atoms | 29 |
| Complexity | 1066.4515 |
Chemical Identifiers
| CAS Number | 355115-36-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=CC=CS5 |
Product Overview
BAS 02916416 (CAS 355115-36-5), with molecular formula C22H17ClN2O3S and molecular weight 424.06 g/mol. IUPAC: 2-(4-chlorophenyl)-5-(4-methylphenyl)-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of BAS 02916416
Property Insights of BAS 02916416
The XLogP value of 4.76102 indicates that BAS 02916416 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 02916416 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02916416 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 02916416?
The CAS number of BAS 02916416 is 355115-36-5.
What is the molecular formula of BAS 02916416?
The molecular formula of BAS 02916416 is C22H17ClN2O3S.
What is the molecular weight of BAS 02916416?
The molecular weight of BAS 02916416 is 424.06 g/mol.
Where can I buy BAS 02916416?
You can request a quote for BAS 02916416 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02916416?
Yes, KEHONG BIO provides custom synthesis services for BAS 02916416 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.