N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide
TL;DR: N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide (CAS 103137-93-5) is a chemical compound with molecular formula C17H30N4O5 and molecular weight 370.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl (2S)-2-[[(2R)-1-[[(2S)-2-(methylamino)propanoyl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate
Also Known As: BPAAM, N-t-Boc-pro-ala-ala-nhch3, N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide, tert-butyl (2S)-2-[[(2R)-1-[[(2S)-2-(methylamino)propanoyl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate, 1-((1,1-Dimethylethoxy)carbonyl)-L-prolyl-D-alanyl-N-methyl-L-alaninamide
| Molecular Formula | C17H30N4O5 |
|---|---|
| Molecular Weight | 370.22 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 370.22162 |
| Heavy Atoms | 26 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 103137-93-5 |
|---|---|
| SMILES | C[C@@H](C(=O)NC(=O)[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)NC |
| InChIKey | CERPSWNFVMCZAO-TUAOUCFPSA-N |
Product Overview
N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide (CAS 103137-93-5), with molecular formula C17H30N4O5 and molecular weight 370.22 g/mol. IUPAC: tert-butyl (2S)-2-[[(2R)-1-[[(2S)-2-(methylamino)propanoyl]amino]-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate.
Chemical Property Profile of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide
Property Insights of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide. Following Lipinski's Rule of Five, N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide has 3 hydrogen bond donor(s) and 6 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-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide?
The CAS number of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide is 103137-93-5.
What is the molecular formula of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide?
The molecular formula of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide is C17H30N4O5.
What is the molecular weight of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide?
The molecular weight of N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide is 370.22 g/mol.
Where can I buy N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide?
You can request a quote for N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-Butyloxycarbonyl-prolyl-alanyl-alanyl-methylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.