![S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate structure](/static/products/1675/1675-71-4.webp)
S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate
TL;DR: S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate (CAS 1675-71-4) is a chemical compound with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-but-2-en-2-yl]-5-ethyl-1,3-diazinane-2,4,6-trione
Also Known As: Butabarbital M (OH, -H2O), 2-[3-Indolylmethyl]aminoethylthiophosphate, 5-Ethyl-5-(1-methylpropenyl)barbituric acid, Barbituric acid, 5-ethyl-5-(1-methylpropenyl)-, 5-[(E)-but-2-en-2-yl]-5-ethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C10H14N2O3 |
|---|---|
| Molecular Weight | 210.10 g/mol |
| LogP | 0.715 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.10045 |
| Heavy Atoms | 15 |
| Complexity | 337.67902 |
Chemical Identifiers
| CAS Number | 1675-71-4 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)NC1=O)/C(=C/C)/C |
Product Overview
S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate (CAS 1675-71-4), with molecular formula C10H14N2O3 and molecular weight 210.10 g/mol. IUPAC: 5-[(E)-but-2-en-2-yl]-5-ethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate
Property Insights of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate
The XLogP value of 0.715 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate. Following Lipinski's Rule of Five, S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate?
The CAS number of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate is 1675-71-4.
What is the molecular formula of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate?
The molecular formula of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate is C10H14N2O3.
What is the molecular weight of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate?
The molecular weight of S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate is 210.10 g/mol.
Where can I buy S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate?
You can request a quote for S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-[(1H-Indol-3-ylmethyl)amino]ethyl) dihydrogen thiophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.