Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)
TL;DR: Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) (CAS 31751-95-8) is a chemical compound with molecular formula C22H23NO5S and molecular weight 413.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzo[b][1]benzothiepin-5-yloxyethyl(dimethyl)azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: 10-(2-Dimethylaminoethoxy)dibenzo(b,f)thiepin hydrogen maleate, 2-(Dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethylethylamine maleate, ETHYLAMINE, 2-(DIBENZO(b,f)THIEPIN-10-YLOXY)-N,N-DIMETHYL-, MALEATE (1:1), 2-benzo[b][1]benzothiepin-5-yloxyethyl(dimethyl)azanium; (Z)-4-hydroxy-4-oxobut-2-enoate, RefChem:1085160
| Molecular Formula | C22H23NO5S |
|---|---|
| Molecular Weight | 413.13 g/mol |
| LogP | 1.1875 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.1297 |
| Heavy Atoms | 29 |
| Complexity | 904.9236 |
Chemical Identifiers
| CAS Number | 31751-95-8 |
|---|---|
| SMILES | C[NH+](C)CCOC1=CC2=CC=CC=C2SC3=CC=CC=C31.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) (CAS 31751-95-8), with molecular formula C22H23NO5S and molecular weight 413.13 g/mol. IUPAC: 2-benzo[b][1]benzothiepin-5-yloxyethyl(dimethyl)azanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)
Property Insights of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)
The XLogP value of 1.1875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1). The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1). Following Lipinski's Rule of Five, Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) has 2 hydrogen bond donor(s) and 5 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 Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)?
The CAS number of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) is 31751-95-8.
What is the molecular formula of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)?
The molecular formula of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) is C22H23NO5S.
What is the molecular weight of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)?
The molecular weight of Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) is 413.13 g/mol.
Where can I buy Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)?
You can request a quote for Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethylamine, 2-(dibenzo(b,f)thiepin-10-yloxy)-N,N-dimethyl-, maleate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.