RefChem:1058517
TL;DR: RefChem:1058517 (CAS 61326-53-2) is a chemical compound with molecular formula C24H23N3O5 and molecular weight 433.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-(1H-indol-3-ylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol
Also Known As: 2,3,4,9-Tetrahydro-1-(3-indolylmethyl)-1H-pyrido(3,4-b)indol-6-ol (E)-2-butenedioate (1:1), 1H-Pyrido(3,4-b)indol-6-ol, 2,3,4,9-tetrahydro-1-(3-indolylmethyl)-, (E)-2-butenedioate (1:1), (Indolyl-3' methyl)-1 tetrahydro-2,3,4,9-1H-beta-carbolinol-6 fumarate [French], 6-Hydroxy-1-(3'-indolylmethyl)-1,2,3,4-tetrahydro(9H)pyrido(3,4)indole fumarate, (Indolyl-3' methyl)-1 tetrahydro-2,3,4,9-1H-beta-carbolinol-6 fumarate
| Molecular Formula | C24H23N3O5 |
|---|---|
| Molecular Weight | 433.16 g/mol |
| LogP | 3.4961 |
| Topological Polar Surface Area | 138.44 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 433.16376 |
| Heavy Atoms | 32 |
| Complexity | 1301.9237 |
Chemical Identifiers
| CAS Number | 61326-53-2 |
|---|---|
| SMILES | C1CNC(C2=C1C3=C(N2)C=CC(=C3)O)CC4=CNC5=CC=CC=C54.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1058517 (CAS 61326-53-2), with molecular formula C24H23N3O5 and molecular weight 433.16 g/mol. IUPAC: (E)-but-2-enedioic acid;1-(1H-indol-3-ylmethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol.
Chemical Property Profile of RefChem:1058517
Property Insights of RefChem:1058517
The XLogP value of 3.4961 indicates that RefChem:1058517 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.44 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058517. Following Lipinski's Rule of Five, RefChem:1058517 has 6 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1058517?
The CAS number of RefChem:1058517 is 61326-53-2.
What is the molecular formula of RefChem:1058517?
The molecular formula of RefChem:1058517 is C24H23N3O5.
What is the molecular weight of RefChem:1058517?
The molecular weight of RefChem:1058517 is 433.16 g/mol.
Where can I buy RefChem:1058517?
You can request a quote for RefChem:1058517 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058517?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058517 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.