oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-
TL;DR: oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- (CAS 60705-31-9) is a chemical compound with molecular formula C7H8N2O and molecular weight 136.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole
Also Known As: oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-, 2-(1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole, InChI=1/C7H8N2O/c1-2-6(8-3-1)7-9-4-5-10-7/h1-3,8H,4-5H
| Molecular Formula | C7H8N2O |
|---|---|
| Molecular Weight | 136.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.06366 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 60705-31-9 |
|---|---|
| SMILES | C1COC(=N1)C2=CC=CN2 |
| InChIKey | XSOZKYXBOWWKKJ-UHFFFAOYSA-N |
Product Overview
oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- (CAS 60705-31-9), with molecular formula C7H8N2O and molecular weight 136.06 g/mol. IUPAC: 2-(1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole.
Chemical Property Profile of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-
Property Insights of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-. With a topological polar surface area (TPSA) of 37.4 Ų, oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- has 1 hydrogen bond donor(s) and 2 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 oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-?
The CAS number of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- is 60705-31-9.
What is the molecular formula of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-?
The molecular formula of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- is C7H8N2O.
What is the molecular weight of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-?
The molecular weight of oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- is 136.06 g/mol.
Where can I buy oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-?
You can request a quote for oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for oxazole, 4,5-dihydro-2-(1H-pyrrol-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.