Ccris 3554
TL;DR: Ccris 3554 (CAS 129101-32-2) is a chemical compound with molecular formula C24H31N3O5 and molecular weight 441.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl) N-ethyl-N-methylcarbamate;2-hydroxybenzoic acid
Also Known As: Dimethylphysostigmine salicylate, (3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl) N-ethyl-N-methylcarbamate; 2-hydroxybenzoic acid, 2-Hydroxybenzoic acid--1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-yl ethyl(methyl)carbamate (1/1)
| Molecular Formula | C24H31N3O5 |
|---|---|
| Molecular Weight | 441.23 g/mol |
| LogP | 3.5966 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 441.22638 |
| Heavy Atoms | 32 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 129101-32-2 |
|---|---|
| SMILES | CCN(C)C(=O)OC1=CC2=C(C=C1)N(C3C2(CCN3C)C)C.C1=CC=C(C(=C1)C(=O)O)O |
| InChIKey | ABFKLONNGOAUGG-UHFFFAOYSA-N |
Product Overview
Ccris 3554 (CAS 129101-32-2), with molecular formula C24H31N3O5 and molecular weight 441.23 g/mol. IUPAC: (3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl) N-ethyl-N-methylcarbamate;2-hydroxybenzoic acid.
Chemical Property Profile of Ccris 3554
Property Insights of Ccris 3554
The XLogP value of 3.5966 indicates that Ccris 3554 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ccris 3554. Following Lipinski's Rule of Five, Ccris 3554 has 2 hydrogen bond donor(s) and 7 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 Ccris 3554?
The CAS number of Ccris 3554 is 129101-32-2.
What is the molecular formula of Ccris 3554?
The molecular formula of Ccris 3554 is C24H31N3O5.
What is the molecular weight of Ccris 3554?
The molecular weight of Ccris 3554 is 441.23 g/mol.
Where can I buy Ccris 3554?
You can request a quote for Ccris 3554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ccris 3554?
Yes, KEHONG BIO provides custom synthesis services for Ccris 3554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.