4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one
TL;DR: 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one (CAS 40190-75-8) is a chemical compound with molecular formula C25H31NO4 and molecular weight 409.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(tert-butylamino)-3-(9-oxofluoren-4-yl)oxypropan-2-yl] 2,2-dimethylpropanoate
Also Known As: 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one, 4-(3-tert-Butylamino-2-pivaloyloxypropoxy)-9H-fluoren-9-one, 1-(tert-butylamino)-3-[(9-oxo-9H-fluoren-4-yl)oxy]propan-2-yl 2,2-dimethylpropanoate, [1-(9-oxofluoren-4-yl)oxy-3-(tert-butylamino)propan-2-yl] 2,2-dimethylpropanoate, [1-(tert-butylamino)-3-(9-oxofluoren-4-yl)oxypropan-2-yl] 2,2-dimethylpropanoate
| Molecular Formula | C25H31NO4 |
|---|---|
| Molecular Weight | 409.23 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 409.2253 |
| Heavy Atoms | 30 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 40190-75-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)OC(CNC(C)(C)C)COC1=CC=CC2=C1C3=CC=CC=C3C2=O |
| InChIKey | BVYLTKDJPZBYJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one (CAS 40190-75-8), with molecular formula C25H31NO4 and molecular weight 409.23 g/mol. IUPAC: [1-(tert-butylamino)-3-(9-oxofluoren-4-yl)oxypropan-2-yl] 2,2-dimethylpropanoate.
Chemical Property Profile of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one
Property Insights of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one
The XLogP value of 4.9 indicates that 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one. Following Lipinski's Rule of Five, 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one has 1 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 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one?
The CAS number of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one is 40190-75-8.
What is the molecular formula of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one?
The molecular formula of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one is C25H31NO4.
What is the molecular weight of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one?
The molecular weight of 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one is 409.23 g/mol.
Where can I buy 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one?
You can request a quote for 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-tert-Butylamino-2-pivalyloxypropoxy)-9H-fluoren-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.