1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-
TL;DR: 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- (CAS 86758-92-1) is a chemical compound with molecular formula C27H29N3O2S and molecular weight 459.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]-1-(3,4-dimethoxyphenyl)methanimine
Also Known As: 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-, N-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]-1-(3,4-dimethoxyphenyl)methanimine
| Molecular Formula | C27H29N3O2S |
|---|---|
| Molecular Weight | 459.20 g/mol |
| LogP | 5.1039 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.19806 |
| Heavy Atoms | 33 |
| Complexity | 1141.7153 |
Chemical Identifiers
| CAS Number | 86758-92-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=NN2CCN(CC2)C3CC4=CC=CC=C4SC5=CC=CC=C35)OC |
Product Overview
1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- (CAS 86758-92-1), with molecular formula C27H29N3O2S and molecular weight 459.20 g/mol. IUPAC: N-[4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazin-1-yl]-1-(3,4-dimethoxyphenyl)methanimine.
Chemical Property Profile of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-
Property Insights of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-
The XLogP value of 5.1039 indicates that 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-?
The CAS number of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- is 86758-92-1.
What is the molecular formula of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-?
The molecular formula of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- is C27H29N3O2S.
What is the molecular weight of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-?
The molecular weight of 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- is 459.20 g/mol.
Where can I buy 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-?
You can request a quote for 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((3,4-dimethoxyphenyl)methylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.