![(3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione structure](/static/products/121/1212419-32-3.png)
(3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
TL;DR: (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione (CAS 1212419-32-3) is a chemical compound with molecular formula C21H13N3O5 and molecular weight 387.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,6aS)-5-naphthalen-2-yl-3-(4-nitrophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione, (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, (3aR,6aS)-5-naphthalen-2-yl-3-(4-nitrophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C21H13N3O5 |
|---|---|
| Molecular Weight | 387.09 g/mol |
| LogP | 3.0405 |
| Topological Polar Surface Area | 102.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.0855 |
| Heavy Atoms | 29 |
| Complexity | 1218.4735 |
Chemical Identifiers
| CAS Number | 1212419-32-3 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)N3C(=O)[C@H]4[C@@H](C3=O)ON=C4C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
(3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione (CAS 1212419-32-3), with molecular formula C21H13N3O5 and molecular weight 387.09 g/mol. IUPAC: (3aR,6aS)-5-naphthalen-2-yl-3-(4-nitrophenyl)-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Property Insights of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
The XLogP value of 3.0405 indicates that (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.11 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione. Following Lipinski's Rule of Five, (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-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-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione?
The CAS number of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione is 1212419-32-3.
What is the molecular formula of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione?
The molecular formula of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione is C21H13N3O5.
What is the molecular weight of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione?
The molecular weight of (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione is 387.09 g/mol.
Where can I buy (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione?
You can request a quote for (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-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-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione?
Yes, KEHONG BIO provides custom synthesis services for (3aR,6aS)-5-(naphthalen-2-yl)-3-(4-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.