3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-
TL;DR: 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- (CAS 123102-14-7) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyrrolidin-1-yl-3,1-benzoxazin-4-one
Also Known As: 2-pyrrolidino-4H-3,1-benzoxazin-4-one, 2-Pyrrolizino-4H-3,1-benzoxazin-4-one, 2-pyrrolidin-1-yl-3,1-benzoxazin-4-one, 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-, 2-(pyrrolidin-1-yl)-4H-3,1-benzoxazin-4-one
Technical Specifications
| Molecular Formula | C12H12N2O2 |
| Molecular Weight | 216.08987 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.08987 Da |
| Heavy Atoms | 16 |
| Complexity | 321.0 |
| SMILES | C1CCN(C1)C2=NC3=CC=CC=C3C(=O)O2 |
| InChIKey | FPJDJGARVSINNC-UHFFFAOYSA-N |
Chemical Property Profile of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-
Property Insights of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-. With a topological polar surface area (TPSA) of 41.9 Ų, 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- 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
What is the CAS number of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-?
The CAS number of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- is 123102-14-7.
What is the molecular formula of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-?
The molecular formula of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- is C12H12N2O2.
What is the molecular weight of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-?
The molecular weight of 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- is 216.08987 g/mol.
Where can I buy 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-?
You can request a quote for 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)-?
Yes, CoreyChem provides custom synthesis services for 3,1-Benzoxazin-4-one, 2-(1-pyrrolidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.