Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-
TL;DR: Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- (CAS 73029-66-0) is a chemical compound with molecular formula C19H22N2O2S and molecular weight 342.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine-3,8-diol
Also Known As: 5-23-02-00486 (Beilstein Handbook Reference), 2,8-Dihydroxy-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin, 10,11-Dihydro-10-(4-methyl-1-piperazinyl)dibenzo(b,f)thiepin-2,8-diol, AE-641/30150029, Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-
| Molecular Formula | C19H22N2O2S |
|---|---|
| Molecular Weight | 342.14 g/mol |
| LogP | 3.0936 |
| Topological Polar Surface Area | 46.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 342.1402 |
| Heavy Atoms | 24 |
| Complexity | 757.02716 |
Chemical Identifiers
| CAS Number | 73029-66-0 |
|---|---|
| SMILES | CN1CCN(CC1)C2CC3=C(C=CC(=C3)O)SC4=C2C=C(C=C4)O |
Product Overview
Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- (CAS 73029-66-0), with molecular formula C19H22N2O2S and molecular weight 342.14 g/mol. IUPAC: 5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepine-3,8-diol.
Chemical Property Profile of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-
Property Insights of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-
The XLogP value of 3.0936 indicates that Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.94 Ų, Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- 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 Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-?
The CAS number of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- is 73029-66-0.
What is the molecular formula of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-?
The molecular formula of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- is C19H22N2O2S.
What is the molecular weight of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-?
The molecular weight of Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- is 342.14 g/mol.
Where can I buy Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-?
You can request a quote for Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,f)thiepin-2,8-diol, 10,11-dihydro-10-(4-methyl-1-piperazinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.