1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate
TL;DR: 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate (CAS 64431-71-6) is a chemical compound with molecular formula C15H23NO3 and molecular weight 265.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 5-oxopyrrolidine-2-carboxylate
Also Known As: EINECS 264-896-7, 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl 5-oxo-DL-prolinate, (4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 5-oxopyrrolidine-2-carboxylate, Proline, 5-oxo-,1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester
| Molecular Formula | C15H23NO3 |
|---|---|
| Molecular Weight | 265.17 g/mol |
| LogP | 2.023 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.1678 |
| Heavy Atoms | 19 |
| Complexity | 431.10663 |
Chemical Identifiers
| CAS Number | 64431-71-6 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2)OC(=O)C3CCC(=O)N3)C)C |
Product Overview
1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate (CAS 64431-71-6), with molecular formula C15H23NO3 and molecular weight 265.17 g/mol. IUPAC: (1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 5-oxopyrrolidine-2-carboxylate.
Chemical Property Profile of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate
Property Insights of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate
The XLogP value of 2.023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate. With a topological polar surface area (TPSA) of 55.4 Ų, 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate has 1 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 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate?
The CAS number of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate is 64431-71-6.
What is the molecular formula of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate?
The molecular formula of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate is C15H23NO3.
What is the molecular weight of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate?
The molecular weight of 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate is 265.17 g/mol.
Where can I buy 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate?
You can request a quote for 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate?
Yes, KEHONG BIO provides custom synthesis services for 1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 5-oxo-DL-prolinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.