RefChem:378074
TL;DR: RefChem:378074 (CAS 29128-69-6) is a chemical compound with molecular formula C21H23N and molecular weight 289.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidenemethyl)pyrrolidine
Also Known As: MJ 1997-1, MJ-1997-1, Pyrrolidine, 3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidenemethyl)-1-methyl,, 3-(5,6-dihydrodibenzo[1,2-a:1',2'-e][7]annulen-11-ylidenemet, 3-(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidenemethyl)-1-methylpyrrolidine
| Molecular Formula | C21H23N |
|---|---|
| Molecular Weight | 289.18 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.18304 |
| Heavy Atoms | 22 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 29128-69-6 |
|---|---|
| SMILES | CN1CCC(C1)C=C2C3=CC=CC=C3CCC4=CC=CC=C42 |
| InChIKey | XGTMDFMSBGZUBR-UHFFFAOYSA-N |
Product Overview
RefChem:378074 (CAS 29128-69-6), with molecular formula C21H23N and molecular weight 289.18 g/mol. IUPAC: 1-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidenemethyl)pyrrolidine.
Chemical Property Profile of RefChem:378074
Property Insights of RefChem:378074
The XLogP value of 4.3 indicates that RefChem:378074 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, RefChem:378074 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:378074 has 0 hydrogen bond donor(s) and 1 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:378074?
The CAS number of RefChem:378074 is 29128-69-6.
What is the molecular formula of RefChem:378074?
The molecular formula of RefChem:378074 is C21H23N.
What is the molecular weight of RefChem:378074?
The molecular weight of RefChem:378074 is 289.18 g/mol.
Where can I buy RefChem:378074?
You can request a quote for RefChem:378074 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378074?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378074 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.