Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-
TL;DR: Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- (CAS 42981-88-4) is a chemical compound with molecular formula C21H25NO2 and molecular weight 323.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(diethylaminomethyl)-6-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaen-2-ol
Also Known As: 1-(Diethylamino)methyl-2-methoxydibenzo(a,e)cycloheptatrien-5-ol, Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-, 2,6-Di-tert-butyl-1,2,3,4-tetrahydro-naphthalene, 1-(Diethylamino)methyl-2-methoxy-5H-dibenzo[a,d]cyclohepten-5-ol, 1-[(diethylamino)methyl]-2-methoxy-5H-dibenzo[a,d][7]annulen-5-ol
| Molecular Formula | C21H25NO2 |
|---|---|
| Molecular Weight | 323.19 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.18854 |
| Heavy Atoms | 24 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 42981-88-4 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC2=C1C=CC3=CC=CC=C3C2O)OC |
| InChIKey | RZTROXDJYTXGSW-UHFFFAOYSA-N |
Product Overview
Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- (CAS 42981-88-4), with molecular formula C21H25NO2 and molecular weight 323.19 g/mol. IUPAC: 7-(diethylaminomethyl)-6-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaen-2-ol.
Chemical Property Profile of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-
Property Insights of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-
The XLogP value of 3.8 indicates that Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.7 Ų, Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- has 1 hydrogen bond donor(s) and 3 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 Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-?
The CAS number of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- is 42981-88-4.
What is the molecular formula of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-?
The molecular formula of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- is C21H25NO2.
What is the molecular weight of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-?
The molecular weight of Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- is 323.19 g/mol.
Where can I buy Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-?
You can request a quote for Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(a,e)cycloheptatrien-5-ol, 1-(diethylamino)methyl-2-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.