Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-
TL;DR: Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- (CAS 65647-03-2) is a chemical compound with molecular formula C51H73N13O11S2 and molecular weight 1107.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-1-[(2S)-2-[[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-cyclohexylacetyl)amino]-3-(7-hydroxy-3,8-dithiatricyclo[5.1.0.02,4]octa-1,5-dien-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]butanediamide
Also Known As: Cyclo-dvdavp, 1-(beta-Mercapto-beta-beta-cyclopentamethylenepropionic acid)-4-val-argipressin, Arginine vasopressin, mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-val(4)-, Argipressin, beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-val(4)-, Vasopressin, 1-(1-mercaptocyclohexaneacetic acid)-4-L-valine-8-D-arginine-
| Molecular Formula | C51H73N13O11S2 |
|---|---|
| Molecular Weight | 1107.50 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 445.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 28 |
| Exact Mass | 1107.4994 |
| Heavy Atoms | 77 |
| Complexity | 2350.0 |
Chemical Identifiers
| CAS Number | 65647-03-2 |
|---|---|
| SMILES | C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC34C=CC5(C(=C3S4)S5)O)NC(=O)CC6CCCCC6 |
| InChIKey | XUQKEOSYGYYCLL-KQYGYMALSA-N |
Product Overview
Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- (CAS 65647-03-2), with molecular formula C51H73N13O11S2 and molecular weight 1107.50 g/mol. IUPAC: (2S)-N-[(2S)-1-[(2S)-2-[[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-cyclohexylacetyl)amino]-3-(7-hydroxy-3,8-dithiatricyclo[5.1.0.02,4]octa-1,5-dien-4-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]butanediamide.
Chemical Property Profile of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-
Property Insights of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-
The XLogP value of -0.3 indicates that Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 445.0 Ų indicates high polarity, suggesting Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- has 12 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-?
The CAS number of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- is 65647-03-2.
What is the molecular formula of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-?
The molecular formula of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- is C51H73N13O11S2.
What is the molecular weight of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-?
The molecular weight of Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- is 1107.50 g/mol.
Where can I buy Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-?
You can request a quote for Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)-?
Yes, KEHONG BIO provides custom synthesis services for Argipressin,beta-mercapto-beta,beta-cyclopentamethylenepropionic acid(1)-Val(4)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.