Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-
TL;DR: Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- (CAS 1238-79-5) is a chemical compound with molecular formula C20H28FNO2 and molecular weight 333.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(7,9-dimethyl-8-oxa-2-azaspiro[4.5]decan-2-yl)-1-(4-fluorophenyl)butan-1-one
Also Known As: 4-(7,9-Dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-butyrophenone, BUTYROPHENONE, 4-(7,9-DIMETHYL-8-OXA-2-AZASPIRO(4.5)DEC-2-YL)-4'-FLUORO-, 4-(7,9-dimethyl-8-oxa-2-azaspiro[4.5]decan-2-yl)-1-(4-fluorophenyl)butan-1-one, 4-(7,9-dimethyl-8-oxa-3-azaspiro[4.5]decan-3-yl)-1-(4-fluorophenyl)butan-1-one, 4-{7,9-DIMETHYL-8-OXA-2-AZASPIRO[4.5]DECAN-2-YL}-1-(4-FLUOROPHENYL)BUTAN-1-ONE
| Molecular Formula | C20H28FNO2 |
|---|---|
| Molecular Weight | 333.21 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.21042 |
| Heavy Atoms | 24 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 1238-79-5 |
|---|---|
| SMILES | CC1CC2(CCN(C2)CCCC(=O)C3=CC=C(C=C3)F)CC(O1)C |
| InChIKey | QICDRFZUEJYNEL-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- (CAS 1238-79-5), with molecular formula C20H28FNO2 and molecular weight 333.21 g/mol. IUPAC: 4-(7,9-dimethyl-8-oxa-2-azaspiro[4.5]decan-2-yl)-1-(4-fluorophenyl)butan-1-one.
Chemical Property Profile of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-
Property Insights of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-
The XLogP value of 3.5 indicates that Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- has 0 hydrogen bond donor(s) and 4 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 Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-?
The CAS number of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- is 1238-79-5.
What is the molecular formula of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-?
The molecular formula of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- is C20H28FNO2.
What is the molecular weight of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-?
The molecular weight of Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- is 333.21 g/mol.
Where can I buy Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-?
You can request a quote for Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro-?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 4-(7,9-dimethyl-8-oxa-2-azaspiro(4.5)dec-2-yl)-4'-fluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.