4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-
TL;DR: 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- (CAS 41822-49-5) is a chemical compound with molecular formula C28H31NO and molecular weight 397.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,6R)-4,5-diphenyl-2-piperidin-1-yltricyclo[5.2.2.02,6]undec-4-en-3-one
Also Known As: 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-, 2,3-Diphenyl-7a-(1-piperidinyl)-3a,4,5,6,7,7a-hexahydro-4,7-ethano-1H-inden-1-one (cis)-, (3aR,7aS)-2,3-Diphenyl-7a-(piperidin-1-yl)-3a,4,5,6,7,7a-hexahydro-1H-4,7-ethanoinden-1-one
| Molecular Formula | C28H31NO |
|---|---|
| Molecular Weight | 397.24 g/mol |
| LogP | 5.841 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.24057 |
| Heavy Atoms | 30 |
| Complexity | 964.2134 |
Chemical Identifiers
| CAS Number | 41822-49-5 |
|---|---|
| SMILES | C1CCN(CC1)[C@]23[C@H](C4CCC2CC4)C(=C(C3=O)C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- (CAS 41822-49-5), with molecular formula C28H31NO and molecular weight 397.24 g/mol. IUPAC: (2S,6R)-4,5-diphenyl-2-piperidin-1-yltricyclo[5.2.2.02,6]undec-4-en-3-one.
Chemical Property Profile of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-
Property Insights of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-
The XLogP value of 5.841 indicates that 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- 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 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-?
The CAS number of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- is 41822-49-5.
What is the molecular formula of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-?
The molecular formula of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- is C28H31NO.
What is the molecular weight of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-?
The molecular weight of 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- is 397.24 g/mol.
Where can I buy 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-?
You can request a quote for 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis-?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Ethano-1H-inden-1-one, 3a,4,5,6,7,7a-hexahydro-2,3-diphenyl-7a-(1-piperidinyl)-, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.