Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-
TL;DR: Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- (CAS 119617-72-0) is a chemical compound with molecular formula C55H80N14O12S2 and molecular weight 1192.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-4-amino-1-[[(2R)-1-[(2S)-2-[[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-sulfanylidenepropan-2-yl]amino]-1,4-dioxobutan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[2-(4-tert-butyl-1-sulfanylcyclohexyl)acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenylpropanoyl]amino]pentanediamide
Also Known As: Bcadavp, Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-, 1-(4-tert-Butyl-1-mercaptocyclohexaneacetic acid)-argipressin, Arginine vasopressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-, Vasopressin, 1-(4-(1,1-dimethylethyl)-1-mercaptocyclohexaneacetic acid)-8-D-arginine-
| Molecular Formula | C55H80N14O12S2 |
|---|---|
| Molecular Weight | 1192.55 g/mol |
| LogP | -1.8321 |
| Topological Polar Surface Area | 437.91 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 31 |
| Exact Mass | 1192.5521 |
| Heavy Atoms | 83 |
| Complexity | 2681.3398 |
Chemical Identifiers
| CAS Number | 119617-72-0 |
|---|---|
| SMILES | CC(C)(C)C1CCC(CC1)(CC(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C=S)C(=O)N4CCC[C@H]4C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N)S |
Product Overview
Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- (CAS 119617-72-0), with molecular formula C55H80N14O12S2 and molecular weight 1192.55 g/mol. IUPAC: (2S)-N-[(2S)-4-amino-1-[[(2R)-1-[(2S)-2-[[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-sulfanylidenepropan-2-yl]amino]-1,4-dioxobutan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[2-(4-tert-butyl-1-sulfanylcyclohexyl)acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-phenylpropanoyl]amino]pentanediamide.
Chemical Property Profile of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-
Property Insights of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-
The XLogP value of -1.8321 indicates that Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic 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, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- has 14 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, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-?
The CAS number of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- is 119617-72-0.
What is the molecular formula of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-?
The molecular formula of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- is C55H80N14O12S2.
What is the molecular weight of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-?
The molecular weight of Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- is 1192.55 g/mol.
Where can I buy Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-?
You can request a quote for Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic 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, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)-?
Yes, KEHONG BIO provides custom synthesis services for Argipressin, (4-tert-butyl-1-mercaptocyclohexaneacetic acid)(1)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.