Desmopressin acetate anhydrous
TL;DR: Desmopressin acetate anhydrous (CAS 16789-98-3) is a chemical compound with molecular formula C48H68N14O14S2 and molecular weight 1128.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;(2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16S)-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]pyrrolidine-2-carboxamide
Also Known As: Desmopressin acetate, Octostim, Stimate, Minirine, Minirin
| Molecular Formula | C48H68N14O14S2 |
|---|---|
| Molecular Weight | 1128.45 g/mol |
| LogP | -4.2508 |
| Topological Polar Surface Area | 475.21 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 19 |
| Exact Mass | 1128.4481 |
| Heavy Atoms | 78 |
| Complexity | 2482.248 |
Chemical Identifiers
| CAS Number | 16789-98-3 |
|---|---|
| SMILES | CC(=O)O.C1C[C@H](N(C1)C(=O)[C@@H]2CSSCCC(=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)C(=O)N[C@H](CCCN=C(N)N)C(=O)NCC(=O)N |
Product Overview
Desmopressin acetate anhydrous (CAS 16789-98-3), with molecular formula C48H68N14O14S2 and molecular weight 1128.45 g/mol. IUPAC: acetic acid;(2S)-N-[(2R)-1-[(2-amino-2-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-1-[(4R,7S,10S,13S,16S)-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]pyrrolidine-2-carboxamide.
Chemical Property Profile of Desmopressin acetate anhydrous
Property Insights of Desmopressin acetate anhydrous
The XLogP value of -4.2508 indicates that Desmopressin acetate anhydrous is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 475.21 Ų indicates high polarity, suggesting Desmopressin acetate anhydrous may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desmopressin acetate anhydrous has 14 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desmopressin acetate anhydrous?
The CAS number of Desmopressin acetate anhydrous is 16789-98-3.
What is the molecular formula of Desmopressin acetate anhydrous?
The molecular formula of Desmopressin acetate anhydrous is C48H68N14O14S2.
What is the molecular weight of Desmopressin acetate anhydrous?
The molecular weight of Desmopressin acetate anhydrous is 1128.45 g/mol.
Where can I buy Desmopressin acetate anhydrous?
You can request a quote for Desmopressin acetate anhydrous directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desmopressin acetate anhydrous?
Yes, KEHONG BIO provides custom synthesis services for Desmopressin acetate anhydrous and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.