N-Hpp-asp-lys-azb-thr-NH2
TL;DR: N-Hpp-asp-lys-azb-thr-NH2 (CAS 102604-64-8) is a chemical compound with molecular formula C30H39N9O8 and molecular weight 653.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]-2-[3-(4-hydroxyphenyl)propanoylamino]butanediamide
Also Known As: N-Hpp-asp-lys-azb-thr-NH2, N(alpha)-3-(4-Hydroxyphenylpropionyl)asparaginyl-lysyl-(N(epsilon)-4-azidobenzoyl)threoninamide, (2S)-N-[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]-2-[3-(4-hydroxyphenyl)propanoylamino]butanediamide, N~2~-[3-(4-Hydroxyphenyl)propanoyl]-L-asparaginyl-N~6~-(4-azidobenzoyl)-L-lysyl-L-threoninamide, RefChem:160809
| Molecular Formula | C30H39N9O8 |
|---|---|
| Molecular Weight | 653.29 g/mol |
| LogP | 0.0628 |
| Topological Polar Surface Area | 291.8 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 19 |
| Exact Mass | 653.2922 |
| Heavy Atoms | 47 |
| Complexity | 1458.7162 |
Chemical Identifiers
| CAS Number | 102604-64-8 |
|---|---|
| SMILES | C[C@H]([C@@H](C(=O)N)NC(=O)[C@H](CCCCNC(=O)C1=CC=C(C=C1)N=[N+]=[N-])NC(=O)[C@H](CC(=O)N)NC(=O)CCC2=CC=C(C=C2)O)O |
Product Overview
N-Hpp-asp-lys-azb-thr-NH2 (CAS 102604-64-8), with molecular formula C30H39N9O8 and molecular weight 653.29 g/mol. IUPAC: (2S)-N-[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-6-[(4-azidobenzoyl)amino]-1-oxohexan-2-yl]-2-[3-(4-hydroxyphenyl)propanoylamino]butanediamide.
Chemical Property Profile of N-Hpp-asp-lys-azb-thr-NH2
Property Insights of N-Hpp-asp-lys-azb-thr-NH2
The XLogP value of 0.0628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Hpp-asp-lys-azb-thr-NH2. The TPSA of 291.8 Ų indicates high polarity, suggesting N-Hpp-asp-lys-azb-thr-NH2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Hpp-asp-lys-azb-thr-NH2 has 8 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Hpp-asp-lys-azb-thr-NH2?
The CAS number of N-Hpp-asp-lys-azb-thr-NH2 is 102604-64-8.
What is the molecular formula of N-Hpp-asp-lys-azb-thr-NH2?
The molecular formula of N-Hpp-asp-lys-azb-thr-NH2 is C30H39N9O8.
What is the molecular weight of N-Hpp-asp-lys-azb-thr-NH2?
The molecular weight of N-Hpp-asp-lys-azb-thr-NH2 is 653.29 g/mol.
Where can I buy N-Hpp-asp-lys-azb-thr-NH2?
You can request a quote for N-Hpp-asp-lys-azb-thr-NH2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Hpp-asp-lys-azb-thr-NH2?
Yes, KEHONG BIO provides custom synthesis services for N-Hpp-asp-lys-azb-thr-NH2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.