Cdr2.ame(45-50)
TL;DR: Cdr2.ame(45-50) (CAS 174490-49-4) is a chemical compound with molecular formula C50H74N12O14S2 and molecular weight 1130.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(6S,9S,12R,17R,20S,23S,26R)-6,20-bis(4-aminobutyl)-12-[[(2S)-2-amino-3-phenylpropanoyl]amino]-9-[(1R)-1-hydroxyethyl]-23-(hydroxymethyl)-2,5,8,11,19,22,25-heptaoxo-14,15-dithia-1,4,7,10,18,21,24-heptazabicyclo[24.3.0]nonacosane-17-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid
Also Known As: CDR2.AME(45-50), FCTKGPSKCY (Cyclized/Cysteine-oxidized), L-Tyrosine, L-phenylalanyl-L-cysteinyl-L-threonyl-L-lysylglycyl-L-prolyl-L-seryl-L-lysyl-L-cysteinyl-, cyclic (2-9)-disulfide, (2S)-2-[[(6S,9S,12R,17R,20S,23S,26R)-6,20-bis(4-aminobutyl)-12-[[(2S)-2-amino-3-phenylpropanoyl]amino]-9-[(1R)-1-hydroxyethyl]-23-(hydroxymethyl)-2,5,8,11,19,22,25-heptaoxo-14,15-dithia-1,4,7,10,18,21,24-heptazabicyclo[24.3.0]nonacosane-17-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid, L-Tyrosine, L-phenylalanyl-L-cysteinyl-L-threonyl-L-lysylglycyl-L-prolyl-L-seryl-L-lysyl-L-cysteinyl-, cyclic (2==>9)-disulfide
| Molecular Formula | C50H74N12O14S2 |
|---|---|
| Molecular Weight | 1130.49 g/mol |
| LogP | -3.9 |
| Topological Polar Surface Area | 480.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 19 |
| Exact Mass | 1130.4889 |
| Heavy Atoms | 78 |
| Complexity | 2020.0 |
Chemical Identifiers
| CAS Number | 174490-49-4 |
|---|---|
| SMILES | C[C@H]([C@H]1C(=O)N[C@H](C(=O)NCC(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N1)NC(=O)[C@H](CC3=CC=CC=C3)N)C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O)CCCCN)CO)CCCCN)O |
| InChIKey | OYERTRYXMHYFQW-VQAKXNOLSA-N |
Product Overview
Cdr2.ame(45-50) (CAS 174490-49-4), with molecular formula C50H74N12O14S2 and molecular weight 1130.49 g/mol. IUPAC: (2S)-2-[[(6S,9S,12R,17R,20S,23S,26R)-6,20-bis(4-aminobutyl)-12-[[(2S)-2-amino-3-phenylpropanoyl]amino]-9-[(1R)-1-hydroxyethyl]-23-(hydroxymethyl)-2,5,8,11,19,22,25-heptaoxo-14,15-dithia-1,4,7,10,18,21,24-heptazabicyclo[24.3.0]nonacosane-17-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid.
Chemical Property Profile of Cdr2.ame(45-50)
Property Insights of Cdr2.ame(45-50)
The XLogP value of -3.9 indicates that Cdr2.ame(45-50) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 480.0 Ų indicates high polarity, suggesting Cdr2.ame(45-50) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cdr2.ame(45-50) has 15 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cdr2.ame(45-50)?
The CAS number of Cdr2.ame(45-50) is 174490-49-4.
What is the molecular formula of Cdr2.ame(45-50)?
The molecular formula of Cdr2.ame(45-50) is C50H74N12O14S2.
What is the molecular weight of Cdr2.ame(45-50)?
The molecular weight of Cdr2.ame(45-50) is 1130.49 g/mol.
Where can I buy Cdr2.ame(45-50)?
You can request a quote for Cdr2.ame(45-50) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cdr2.ame(45-50)?
Yes, KEHONG BIO provides custom synthesis services for Cdr2.ame(45-50) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.