N-苄氧羰基甘氨酸丙酮酯
TL;DR: N-苄氧羰基甘氨酸丙酮酯 (CAS 77109-82-1) is a chemical compound with molecular formula C13H15NO5 and molecular weight 265.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄氧羰基甘氨酸丙酮酯
2-oxopropyl 2-(phenylmethoxycarbonylamino)acetate
Also Known As: N-Carbobenzoxyglycine acetonyl ester, N-Benzyloxycarbonylglycine acetonyl ester, 2-oxopropyl 2-(phenylmethoxycarbonylamino)acetate, GLYCINE, N-CARBOXY-, ACETONYL ESTER, N-BENZYL ESTER, 2-Oxopropyl N-[(benzyloxy)carbonyl]glycinate
| Molecular Formula | C13H15NO5 |
|---|---|
| Molecular Weight | 265.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 265.09503 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 77109-82-1 |
|---|---|
| SMILES | CC(=O)COC(=O)CNC(=O)OCC1=CC=CC=C1 |
| InChIKey | IHLPUAJNTAJIQG-UHFFFAOYSA-N |
Product Overview
N-苄氧羰基甘氨酸丙酮酯 (CAS 77109-82-1), with molecular formula C13H15NO5 and molecular weight 265.10 g/mol. IUPAC: 2-oxopropyl 2-(phenylmethoxycarbonylamino)acetate.
Chemical Property Profile of N-苄氧羰基甘氨酸丙酮酯
Property Insights of N-苄氧羰基甘氨酸丙酮酯
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-苄氧羰基甘氨酸丙酮酯. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-苄氧羰基甘氨酸丙酮酯. Following Lipinski's Rule of Five, N-苄氧羰基甘氨酸丙酮酯 has 1 hydrogen bond donor(s) and 5 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 N-苄氧羰基甘氨酸丙酮酯?
The CAS number of N-苄氧羰基甘氨酸丙酮酯 is 77109-82-1.
What is the molecular formula of N-苄氧羰基甘氨酸丙酮酯?
The molecular formula of N-苄氧羰基甘氨酸丙酮酯 is C13H15NO5.
What is the molecular weight of N-苄氧羰基甘氨酸丙酮酯?
The molecular weight of N-苄氧羰基甘氨酸丙酮酯 is 265.10 g/mol.
Where can I buy N-苄氧羰基甘氨酸丙酮酯?
You can request a quote for N-苄氧羰基甘氨酸丙酮酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄氧羰基甘氨酸丙酮酯?
Yes, KEHONG BIO provides custom synthesis services for N-苄氧羰基甘氨酸丙酮酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.