Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-
TL;DR: Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- (CAS 119617-71-9) is a chemical compound with molecular formula C52H74N14O12S2 and molecular weight 1150.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(10R,13S,16S,19S,22S)-13-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-19-benzyl-22-[(4-hydroxyphenyl)methyl]-3-methyl-12,15,18,21,24-pentaoxo-7,8-dithia-11,14,17,20,23-pentazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidine-2-carboxamide
Also Known As: Mecadavp, Mecaavp, Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-, 1-(1-Mercapto-4-methylcyclohexaneacetic acid)-argipressin, Arginine vasopressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-
| Molecular Formula | C52H74N14O12S2 |
|---|---|
| Molecular Weight | 1150.51 g/mol |
| LogP | -2.3928 |
| Topological Polar Surface Area | 437.91 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 19 |
| Exact Mass | 1150.5052 |
| Heavy Atoms | 80 |
| Complexity | 2584.056 |
Chemical Identifiers
| CAS Number | 119617-71-9 |
|---|---|
| SMILES | CC1CCC2(CC1)CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSS2)C(=O)N3CCC[C@H]3C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N)CC4=CC=CC=C4)CC5=CC=C(C=C5)O |
Product Overview
Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- (CAS 119617-71-9), with molecular formula C52H74N14O12S2 and molecular weight 1150.51 g/mol. IUPAC: (2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(10R,13S,16S,19S,22S)-13-(2-amino-2-oxoethyl)-16-(3-amino-3-oxopropyl)-19-benzyl-22-[(4-hydroxyphenyl)methyl]-3-methyl-12,15,18,21,24-pentaoxo-7,8-dithia-11,14,17,20,23-pentazaspiro[5.19]pentacosane-10-carbonyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-
Property Insights of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-
The XLogP value of -2.3928 indicates that Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 437.91 Ų indicates high polarity, suggesting Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- has 13 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-?
The CAS number of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- is 119617-71-9.
What is the molecular formula of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-?
The molecular formula of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- is C52H74N14O12S2.
What is the molecular weight of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-?
The molecular weight of Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- is 1150.51 g/mol.
Where can I buy Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-?
You can request a quote for Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)-?
Yes, KEHONG BIO provides custom synthesis services for Argipressin, (1-mercapto-4-methylcyclohexaneacetic acid)(1)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.