H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H
TL;DR: H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H (CAS 83150-76-9) is a chemical compound with molecular formula C53H74N10O14S2 and molecular weight 1138.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;10-(4-aminobutyl)-19-[(2-amino-3-phenylpropanoyl)amino]-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-(1-hydroxyethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
Also Known As: Octreotide acetate, Sandostatin, Octreotide, Sandostatin LAR, Sandostatin LAR Depot
| Molecular Formula | C53H74N10O14S2 |
|---|---|
| Molecular Weight | 1138.48 g/mol |
| LogP | -0.62 |
| Topological Polar Surface Area | 457.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 17 |
| Exact Mass | 1138.4828 |
| Heavy Atoms | 79 |
| Complexity | 1780.0 |
Chemical Identifiers
| CAS Number | 83150-76-9 |
|---|---|
| SMILES | C[C@H]([C@@H](CO)NC(=O)C1CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C)O)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N)O.CC(=O)O.CC(=O)O |
| InChIKey | QWFYIFWTVZFPRY-AARKYNAGSA-N |
Product Overview
H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H (CAS 83150-76-9), with molecular formula C53H74N10O14S2 and molecular weight 1138.48 g/mol. IUPAC: acetic acid;10-(4-aminobutyl)-19-[(2-amino-3-phenylpropanoyl)amino]-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-(1-hydroxyethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide.
Chemical Property Profile of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H
Property Insights of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H
The XLogP value of -0.62 indicates that H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 457.0 Ų indicates high polarity, suggesting H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H has 15 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H?
The CAS number of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H is 83150-76-9.
What is the molecular formula of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H?
The molecular formula of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H is C53H74N10O14S2.
What is the molecular weight of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H?
The molecular weight of H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H is 1138.48 g/mol.
Where can I buy H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H?
You can request a quote for H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H?
Yes, KEHONG BIO provides custom synthesis services for H-DL-Phe-DL-Cys(1)-DL-Phe-DL-Trp-DL-Lys-DL-xiThr-DL-Cys(1)-Thr-ol.2CH3CO2H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.