4,7-Difluoro-5,6-dihydroxytryptamine creatinine
TL;DR: 4,7-Difluoro-5,6-dihydroxytryptamine creatinine (CAS 133983-26-3) is a chemical compound with molecular formula C14H19F2N5O7S and molecular weight 439.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol;2-amino-3-methyl-4H-imidazol-5-one;sulfuric acid
Also Known As: 4,7-Dfdtc, 4,7-Difluoro-5,6-dihydroxytryptamine creatinine, 3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol, 3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol;2-amino-3-methyl-4H-imidazol-5-one;sulfuric acid, 2-Amino-1,5-dihydro-1-methyl-4H-imidazol-4-one compd. with 3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol sulfate (1:1:1)
| Molecular Formula | C14H19F2N5O7S |
|---|---|
| Molecular Weight | 439.10 g/mol |
| LogP | -0.5212 |
| Topological Polar Surface Area | 215.56 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 439.09732 |
| Heavy Atoms | 29 |
| Complexity | 1030.8855 |
Chemical Identifiers
| CAS Number | 133983-26-3 |
|---|---|
| SMILES | CN1CC(=O)N=C1N.C1=C(C2=C(N1)C(=C(C(=C2F)O)O)F)CCN.OS(=O)(=O)O |
Product Overview
4,7-Difluoro-5,6-dihydroxytryptamine creatinine (CAS 133983-26-3), with molecular formula C14H19F2N5O7S and molecular weight 439.10 g/mol. IUPAC: 3-(2-aminoethyl)-4,7-difluoro-1H-indole-5,6-diol;2-amino-3-methyl-4H-imidazol-5-one;sulfuric acid.
Chemical Property Profile of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine
Property Insights of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine
The XLogP value of -0.5212 indicates that 4,7-Difluoro-5,6-dihydroxytryptamine creatinine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 215.56 Ų indicates high polarity, suggesting 4,7-Difluoro-5,6-dihydroxytryptamine creatinine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,7-Difluoro-5,6-dihydroxytryptamine creatinine has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine?
The CAS number of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine is 133983-26-3.
What is the molecular formula of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine?
The molecular formula of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine is C14H19F2N5O7S.
What is the molecular weight of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine?
The molecular weight of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine is 439.10 g/mol.
Where can I buy 4,7-Difluoro-5,6-dihydroxytryptamine creatinine?
You can request a quote for 4,7-Difluoro-5,6-dihydroxytryptamine creatinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Difluoro-5,6-dihydroxytryptamine creatinine?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Difluoro-5,6-dihydroxytryptamine creatinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.