5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-
TL;DR: 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- (CAS 54573-40-9) is a chemical compound with molecular formula C21H26N+ and molecular weight 292.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium
Also Known As: J1.518.768I, 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-, 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-, N,N,N-Trimethyl-5H-dibenzo[a,d]cycloheptene-5-(1-propanaminium), 3-(5H-Dibenzo[a,d][7]annulen-5-yl)-N,N,N-trimethylpropan-1-aminium
| Molecular Formula | C21H26N+ |
|---|---|
| Molecular Weight | 292.21 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.2065 |
| Heavy Atoms | 22 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 54573-40-9 |
|---|---|
| SMILES | C[N+](C)(C)CCCC1C2=CC=CC=C2C=CC3=CC=CC=C13 |
| InChIKey | MYYDDAWTROZFMQ-UHFFFAOYSA-N |
Product Overview
5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- (CAS 54573-40-9), with molecular formula C21H26N+ and molecular weight 292.21 g/mol. IUPAC: trimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium.
Chemical Property Profile of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-
Property Insights of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-
The XLogP value of 4.9 indicates that 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- has 0 hydrogen bond donor(s) and 0 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 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-?
The CAS number of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- is 54573-40-9.
What is the molecular formula of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-?
The molecular formula of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- is C21H26N+.
What is the molecular weight of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-?
The molecular weight of 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- is 292.21 g/mol.
Where can I buy 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-?
You can request a quote for 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(a,d)cycloheptene-5-propanaminium, N,N,N-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.