Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-
TL;DR: Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- (CAS 63869-77-2) is a chemical compound with molecular formula C18H19ClINS and molecular weight 443.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-3-(2-iodothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride
Also Known As: N 787 (trans), Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-, trans-9-(3-(Dimethylamino)propylidene)-2-iodo-thioxanthene, hydrochloride, (3E)-3-(2-iodothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine hydrochloride, 1-Propanamine, 3-(2-iodo-9H-thioxanthen-9-ylidene)-N,N-dimethyl-, hydrochloride, (E)-
| Molecular Formula | C18H19ClINS |
|---|---|
| Molecular Weight | 443.00 g/mol |
| LogP | 5.561 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 442.99716 |
| Heavy Atoms | 22 |
| Complexity | 697.2366 |
Chemical Identifiers
| CAS Number | 63869-77-2 |
|---|---|
| SMILES | CN(C)CC/C=C/1\C2=CC=CC=C2SC3=C1C=C(C=C3)I.Cl |
Product Overview
Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- (CAS 63869-77-2), with molecular formula C18H19ClINS and molecular weight 443.00 g/mol. IUPAC: (3E)-3-(2-iodothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-
Property Insights of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-
The XLogP value of 5.561 indicates that Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-?
The CAS number of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- is 63869-77-2.
What is the molecular formula of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-?
The molecular formula of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- is C18H19ClINS.
What is the molecular weight of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-?
The molecular weight of Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- is 443.00 g/mol.
Where can I buy Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-?
You can request a quote for Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Thioxanthene, 9-(3-(dimethylamino)propylidene)-2-iodo-, hydrochloride, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.