Hydroxyneocoprogen I
TL;DR: Hydroxyneocoprogen I (CAS 135500-10-6) is a chemical compound with molecular formula C31H47FeN6O13 and molecular weight 767.25507 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(Z)-5-[3-[5-[3-[acetyl(oxido)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-oxidoamino]-3-methyl-5-oxopent-3-enyl] 2-acetamido-5-[[(E)-4,5-dihydroxy-3-methylpent-2-enoyl]-oxidoamino]pentanoate;iron(3+)
Also Known As: Hydroxyneocoprogen I, HydroxyneocoprogenI, 1,3,5-Triazine-2,4,6-triamine-d6, (5-((3-(5-(3-(Acetylhydroxyamino)propyl)-3,6-dioxo-2-piperazinyl)propyl)hydroxyamino)-3-methyl-5-oxo-3-pentenyl N2-acetyl-N5-(4,5-dihydroxy-3-methyl-1-oxo-2-pentenyl)-N5-hydroxy-L-ornithinato(3-))iron, [(Z)-5-[3-[5-[3-[acetyl(oxido)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-oxidoamino]-3-methyl-5-oxopent-3-enyl] 2-acetamido-5-[[(E)-4,5-dihydroxy-3-methylpent-2-enoyl]-oxidoamino]pentanoate,iron(3+)
Technical Specifications
| Molecular Formula | C31H47FeN6O13 |
| Molecular Weight | 767.25507 g/mol |
| XLogP | -1.0094 |
| Topological Polar Surface Area (TPSA) | 284.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 22 |
| Exact Mass | 767.25507 Da |
| Heavy Atoms | 51 |
| Complexity | 1270.0 |
| SMILES | C/C(=C/C(=O)N(CCCC1C(=O)NC(C(=O)N1)CCCN(C(=O)C)[O-])[O-])/CCOC(=O)C(CCCN(C(=O)/C=C(\C)/C(CO)O)[O-])NC(=O)C.[Fe+3] |
| InChIKey | UHRPREMPADIQSN-HNSQUHKSSA-N |
Chemical Property Profile of Hydroxyneocoprogen I
Property Insights of Hydroxyneocoprogen I
The XLogP value of -1.0094 indicates that Hydroxyneocoprogen I is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 284.0 Ų indicates high polarity, suggesting Hydroxyneocoprogen I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hydroxyneocoprogen I has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Hydroxyneocoprogen I?
The CAS number of Hydroxyneocoprogen I is 135500-10-6.
What is the molecular formula of Hydroxyneocoprogen I?
The molecular formula of Hydroxyneocoprogen I is C31H47FeN6O13.
What is the molecular weight of Hydroxyneocoprogen I?
The molecular weight of Hydroxyneocoprogen I is 767.25507 g/mol.
Where can I buy Hydroxyneocoprogen I?
You can request a quote for Hydroxyneocoprogen I directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hydroxyneocoprogen I?
Yes, CoreyChem provides custom synthesis services for Hydroxyneocoprogen I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.