三甘氨酰赖氨酸加压素
TL;DR: 三甘氨酰赖氨酸加压素 (CAS 14636-12-5) is a chemical compound with molecular formula C52H74N16O15S2 and molecular weight 1226.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三甘氨酰赖氨酸加压素
(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide
Also Known As: Terlipressin, glypressin, glycylpressin, Terlipressin acetate, Terlipressine
| Molecular Formula | C52H74N16O15S2 |
|---|---|
| Molecular Weight | 1226.50 g/mol |
| LogP | -5.8 |
| Topological Polar Surface Area | 563.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 25 |
| Exact Mass | 1226.4961 |
| Heavy Atoms | 85 |
| Complexity | 2380.0 |
| Solubility | 1 |
Chemical Identifiers
| CAS Number | 14636-12-5 |
|---|---|
| SMILES | C1C[C@H](N(C1)C(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)CCC(=O)N)CC3=CC=CC=C3)CC4=CC=C(C=C4)O)NC(=O)CNC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N |
| InChIKey | BENFXAYNYRLAIU-QSVFAHTRSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三甘氨酰赖氨酸加压素 (CAS 14636-12-5), with molecular formula C52H74N16O15S2 and molecular weight 1226.50 g/mol. IUPAC: (2S)-1-[(4R,7S,10S,13S,16S,19R)-19-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[(2S)-6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide.
Chemical Property Profile of 三甘氨酰赖氨酸加压素
Property Insights of 三甘氨酰赖氨酸加压素
The XLogP value of -5.8 indicates that 三甘氨酰赖氨酸加压素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 563.0 Ų indicates high polarity, suggesting 三甘氨酰赖氨酸加压素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 三甘氨酰赖氨酸加压素 has 16 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 三甘氨酰赖氨酸加压素?
The CAS number of 三甘氨酰赖氨酸加压素 is 14636-12-5.
What is the molecular formula of 三甘氨酰赖氨酸加压素?
The molecular formula of 三甘氨酰赖氨酸加压素 is C52H74N16O15S2.
What is the molecular weight of 三甘氨酰赖氨酸加压素?
The molecular weight of 三甘氨酰赖氨酸加压素 is 1226.50 g/mol.
Where can I buy 三甘氨酰赖氨酸加压素?
You can request a quote for 三甘氨酰赖氨酸加压素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三甘氨酰赖氨酸加压素?
Yes, KEHONG BIO provides custom synthesis services for 三甘氨酰赖氨酸加压素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.