![(4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole structure](/static/products/369/369610-45-7.png)
(4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole
TL;DR: (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole (CAS 369610-45-7) is a chemical compound with molecular formula C23H22N2S2 and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-phenyl-3-thiophen-2-yl-4-(thiophen-2-ylmethylidene)-3,3a,5,6,7,8-hexahydrocyclohepta[c]pyrazole
Also Known As: (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole, (4E)-2-phenyl-3-thiophen-2-yl-4-(thiophen-2-ylmethylidene)-3,3a,5,6,7,8-hexahydrocyclohepta[c]pyrazole, (E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole
| Molecular Formula | C23H22N2S2 |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 7.0007 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.12244 |
| Heavy Atoms | 27 |
| Complexity | 939.7068 |
Chemical Identifiers
| CAS Number | 369610-45-7 |
|---|---|
| SMILES | C1CCC2=NN(C(C2/C(=C/C3=CC=CS3)/C1)C4=CC=CS4)C5=CC=CC=C5 |
Product Overview
(4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole (CAS 369610-45-7), with molecular formula C23H22N2S2 and molecular weight 390.12 g/mol. IUPAC: (4E)-2-phenyl-3-thiophen-2-yl-4-(thiophen-2-ylmethylidene)-3,3a,5,6,7,8-hexahydrocyclohepta[c]pyrazole.
Chemical Property Profile of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole
Property Insights of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole
The XLogP value of 7.0007 indicates that (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole?
The CAS number of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole is 369610-45-7.
What is the molecular formula of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole?
The molecular formula of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole is C23H22N2S2.
What is the molecular weight of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole?
The molecular weight of (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole is 390.12 g/mol.
Where can I buy (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole?
You can request a quote for (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole?
Yes, KEHONG BIO provides custom synthesis services for (4E)-2-phenyl-3-(thiophen-2-yl)-4-(thiophen-2-ylmethylidene)-2,3,3a,4,5,6,7,8-octahydrocyclohepta[c]pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.