![1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one structure](/static/products/399/39931-33-4.png)
1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one
TL;DR: 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one (CAS 39931-33-4) is a chemical compound with molecular formula C15H19ClN2O2 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5,5,7,7-tetramethyl-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-2-one
Also Known As: 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one, Pyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one, 1-(4-chlorophenyl)tetrahydro-5,5,7,7-tetramethyl-, 1- -5,6,7,7a-tetrahydro-5,5,7,7-tetramethylpyrrolo[1,2-b][1,2,4]oxadiazol-2 -one, 1-(4-chlorophenyl)-5,5,7,7-tetramethyl-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-2-one, 1-(4-chlorophenyl)-5,5,7,7-tetramethyl-hexahydropyrrolo[1,2-b][1,2,4]oxadiazol-2-one
| Molecular Formula | C15H19ClN2O2 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.1135 |
| Heavy Atoms | 20 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 39931-33-4 |
|---|---|
| SMILES | CC1(CC(N2C1N(C(=O)O2)C3=CC=C(C=C3)Cl)(C)C)C |
| InChIKey | WIFNNQCUGZWANK-UHFFFAOYSA-N |
Product Overview
1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one (CAS 39931-33-4), with molecular formula C15H19ClN2O2 and molecular weight 294.11 g/mol. IUPAC: 1-(4-chlorophenyl)-5,5,7,7-tetramethyl-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-2-one.
Chemical Property Profile of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one
Property Insights of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one
The XLogP value of 4.4 indicates that 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one has 0 hydrogen bond donor(s) and 3 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 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one?
The CAS number of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one is 39931-33-4.
What is the molecular formula of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one?
The molecular formula of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one is C15H19ClN2O2.
What is the molecular weight of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one?
The molecular weight of 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one is 294.11 g/mol.
Where can I buy 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one?
You can request a quote for 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-5,5,7,7-tetramethyltetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.