N-苄氧羰基-脯氨酰-丙氨酸甲酯
TL;DR: N-苄氧羰基-脯氨酰-丙氨酸甲酯 (CAS 135820-81-4) is a chemical compound with molecular formula C17H22N2O5 and molecular weight 334.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄氧羰基-脯氨酰-丙氨酸甲酯
benzyl (2S)-2-[[(2R)-1-methoxy-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate
Also Known As: N-Z-Pro-ala-ome, N-Benzyloxycarbonyl-prolyl-alanine methyl ester, N-benzyloxycarbonyl-prolyl-alaninemethylester, benzyl (2S)-2-[[(2R)-1-methoxy-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate, Methyl 1-[(benzyloxy)carbonyl]-L-prolyl-D-alaninate
| Molecular Formula | C17H22N2O5 |
|---|---|
| Molecular Weight | 334.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.15286 |
| Heavy Atoms | 24 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 135820-81-4 |
|---|---|
| SMILES | C[C@H](C(=O)OC)NC(=O)[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2 |
| InChIKey | WZEHNUMRTRKLTC-OCCSQVGLSA-N |
Product Overview
N-苄氧羰基-脯氨酰-丙氨酸甲酯 (CAS 135820-81-4), with molecular formula C17H22N2O5 and molecular weight 334.15 g/mol. IUPAC: benzyl (2S)-2-[[(2R)-1-methoxy-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate.
Chemical Property Profile of N-苄氧羰基-脯氨酰-丙氨酸甲酯
Property Insights of N-苄氧羰基-脯氨酰-丙氨酸甲酯
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-苄氧羰基-脯氨酰-丙氨酸甲酯. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-苄氧羰基-脯氨酰-丙氨酸甲酯. Following Lipinski's Rule of Five, N-苄氧羰基-脯氨酰-丙氨酸甲酯 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-脯氨酰-丙氨酸甲酯?
The CAS number of N-苄氧羰基-脯氨酰-丙氨酸甲酯 is 135820-81-4.
What is the molecular formula of N-苄氧羰基-脯氨酰-丙氨酸甲酯?
The molecular formula of N-苄氧羰基-脯氨酰-丙氨酸甲酯 is C17H22N2O5.
What is the molecular weight of N-苄氧羰基-脯氨酰-丙氨酸甲酯?
The molecular weight of N-苄氧羰基-脯氨酰-丙氨酸甲酯 is 334.15 g/mol.
Where can I buy N-苄氧羰基-脯氨酰-丙氨酸甲酯?
You can request a quote for N-苄氧羰基-脯氨酰-丙氨酸甲酯 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-脯氨酰-丙氨酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for N-苄氧羰基-脯氨酰-丙氨酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.