![3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione structure](/static/products/102/1024448-39-2.png)
3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
TL;DR: 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1024448-39-2) is a chemical compound with molecular formula C27H20ClN3O4S and molecular weight 517.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 3-(4-chloro-2-oxo-3-phenyl-2,3-dihydro-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, 3-(4-chloro-2-oxo-3-phenyl-2,3-dihydrothiazol-5-yl)-2-phenyl-5-(o-tolyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
| Molecular Formula | C27H20ClN3O4S |
|---|---|
| Molecular Weight | 517.09 g/mol |
| LogP | 4.91192 |
| Topological Polar Surface Area | 71.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 517.0863 |
| Heavy Atoms | 36 |
| Complexity | 1535.6263 |
Chemical Identifiers
| CAS Number | 1024448-39-2 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=C(N(C(=O)S5)C6=CC=CC=C6)Cl |
Product Overview
3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1024448-39-2), with molecular formula C27H20ClN3O4S and molecular weight 517.09 g/mol. IUPAC: 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Property Insights of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
The XLogP value of 4.91192 indicates that 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione. Following Lipinski's Rule of Five, 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The CAS number of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is 1024448-39-2.
What is the molecular formula of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The molecular formula of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is C27H20ClN3O4S.
What is the molecular weight of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The molecular weight of 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is 517.09 g/mol.
Where can I buy 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?
You can request a quote for 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chloro-2-oxo-3-phenyl-1,3-thiazol-5-yl)-5-(2-methylphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.