![(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione structure](/static/products/121/1212178-12-5.png)
(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
TL;DR: (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1212178-12-5) is a chemical compound with molecular formula C18H10Cl2N2O5 and molecular weight 404.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione, (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione, (3aR,6aS)-5-(benzo[d][1,3]dioxol-5-yl)-3-(2,4-dichlorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione
| Molecular Formula | C18H10Cl2N2O5 |
|---|---|
| Molecular Weight | 404.00 g/mol |
| LogP | 3.0146 |
| Topological Polar Surface Area | 77.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.99667 |
| Heavy Atoms | 27 |
| Complexity | 1038.4072 |
Chemical Identifiers
| CAS Number | 1212178-12-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)N3C(=O)[C@H]4[C@@H](C3=O)ON=C4C5=C(C=C(C=C5)Cl)Cl |
Product Overview
(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1212178-12-5), with molecular formula C18H10Cl2N2O5 and molecular weight 404.00 g/mol. IUPAC: (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
Property Insights of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
The XLogP value of 3.0146 indicates that (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[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 77.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione. Following Lipinski's Rule of Five, (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione has 0 hydrogen bond donor(s) and 6 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 (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The CAS number of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is 1212178-12-5.
What is the molecular formula of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The molecular formula of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is C18H10Cl2N2O5.
What is the molecular weight of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?
The molecular weight of (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is 404.00 g/mol.
Where can I buy (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?
You can request a quote for (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[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 (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for (3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2,4-dichlorophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.