5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)
TL;DR: 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) (CAS 1614-57-9) is a chemical compound with molecular formula C20H24ClN and molecular weight 313.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium chloride
Also Known As: LU 3-068, 5H-DIBENZO(a,d)CYCLOHEPTENE-5-PROPYLAMINE, N,N-DIMETHYL-, HYDROCHLORIDE, 5H-Dibenzo[a,d]cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride, 5H-Dibenzo[a,d]cycloheptene-5-propylamine, N,N-dimethyl-, hydrochloride, dimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium;chloride
| Molecular Formula | C20H24ClN |
|---|---|
| Molecular Weight | 313.16 g/mol |
| LogP | 0.23 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.15973 |
| Heavy Atoms | 22 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 1614-57-9 |
|---|---|
| SMILES | C[NH+](C)CCCC1C2=CC=CC=C2C=CC3=CC=CC=C13.[Cl-] |
| InChIKey | VBKNNJQOMLOXQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) (CAS 1614-57-9), with molecular formula C20H24ClN and molecular weight 313.16 g/mol. IUPAC: dimethyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propyl]azanium chloride.
Chemical Property Profile of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)
Property Insights of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)
The XLogP value of 0.23 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 4.4 Ų, 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) has 1 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 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)?
The CAS number of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) is 1614-57-9.
What is the molecular formula of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)?
The molecular formula of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) is C20H24ClN.
What is the molecular weight of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)?
The molecular weight of 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) is 313.16 g/mol.
Where can I buy 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1)?
You can request a quote for 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) 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-propanamine, N,N-dimethyl-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N,N-dimethyl-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.