L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)
TL;DR: L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) (CAS 213314-49-9) is a chemical compound with molecular formula C50H69N15O10 and molecular weight 1039.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,6S,9R,12S,15S,23S)-15-[[(2S)-2-acetamidohexanoyl]amino]-6-[3-(diaminomethylideneamino)propyl]-9-[(4-hydroxyphenyl)methyl]-12-(1H-imidazol-5-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexazacyclotricosane-23-carboxamide
Also Known As: L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)
| Molecular Formula | C50H69N15O10 |
|---|---|
| Molecular Weight | 1039.54 g/mol |
| LogP | -1.5427 |
| Topological Polar Surface Area | 404.99 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 17 |
| Exact Mass | 1039.5352 |
| Heavy Atoms | 75 |
| Complexity | 2634.3184 |
Chemical Identifiers
| CAS Number | 213314-49-9 |
|---|---|
| SMILES | CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CC2=CN=CN2)CC3=CC=C(C=C3)O)CCCN=C(N)N)CC4=CNC5=CC=CC=C54)C(=O)N)NC(=O)C |
Product Overview
L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) (CAS 213314-49-9), with molecular formula C50H69N15O10 and molecular weight 1039.54 g/mol. IUPAC: (3S,6S,9R,12S,15S,23S)-15-[[(2S)-2-acetamidohexanoyl]amino]-6-[3-(diaminomethylideneamino)propyl]-9-[(4-hydroxyphenyl)methyl]-12-(1H-imidazol-5-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexazacyclotricosane-23-carboxamide.
Chemical Property Profile of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)
Property Insights of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)
The XLogP value of -1.5427 indicates that L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 404.99 Ų indicates high polarity, suggesting L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) has 14 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)?
The CAS number of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) is 213314-49-9.
What is the molecular formula of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)?
The molecular formula of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) is C50H69N15O10.
What is the molecular weight of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)?
The molecular weight of L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) is 1039.54 g/mol.
Where can I buy L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)?
You can request a quote for L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI)?
Yes, KEHONG BIO provides custom synthesis services for L-Lysinamide,N-acetyl-L-norleucyl-L-a-aspartyl-L-histidyl-D-tyrosyl-L-arginyl-L-tryptophyl-, (2(R)7)-lactam (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.