RefChem:1066480
TL;DR: RefChem:1066480 (CAS 73816-61-2) is a chemical compound with molecular formula C12H16ClN3O2 and molecular weight 269.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(methylcarbamoyloxy)-1H-indol-3-yl]ethylazanium chloride
Also Known As: 5-Methylcarbamoyloxytryptamine hydrochloride, 3-(2-Aminoethyl)-5-hydroxyindole, methylcarbamate, hydrochloride, Carbamic acid, methyl-, 3-(2-aminoethyl)-5-indolyl ester hydrochloride, INDOL-5-OL, 3-(2-AMINOETHYL)-, METHYLCARBAMATE, HYDROCHLORIDE, 2-[5-(methylcarbamoyloxy)-1H-indol-3-yl]ethylazanium chloride
| Molecular Formula | C12H16ClN3O2 |
|---|---|
| Molecular Weight | 269.09 g/mol |
| LogP | -2.33 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.0931 |
| Heavy Atoms | 18 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 73816-61-2 |
|---|---|
| SMILES | CNC(=O)OC1=CC2=C(C=C1)NC=C2CC[NH3+].[Cl-] |
| InChIKey | GWVXYISURDJNFM-UHFFFAOYSA-N |
Product Overview
RefChem:1066480 (CAS 73816-61-2), with molecular formula C12H16ClN3O2 and molecular weight 269.09 g/mol. IUPAC: 2-[5-(methylcarbamoyloxy)-1H-indol-3-yl]ethylazanium chloride.
Chemical Property Profile of RefChem:1066480
Property Insights of RefChem:1066480
The XLogP value of -2.33 indicates that RefChem:1066480 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1066480. Following Lipinski's Rule of Five, RefChem:1066480 has 3 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 RefChem:1066480?
The CAS number of RefChem:1066480 is 73816-61-2.
What is the molecular formula of RefChem:1066480?
The molecular formula of RefChem:1066480 is C12H16ClN3O2.
What is the molecular weight of RefChem:1066480?
The molecular weight of RefChem:1066480 is 269.09 g/mol.
Where can I buy RefChem:1066480?
You can request a quote for RefChem:1066480 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066480?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066480 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.