V011-4144 Screening compound: ethyl 1-[4-(3,5-difluorobenzoyl)-1-oxa-4-azaspiro[4.5]decane-3-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of ChemDiv screening compound V011-4144
ethyl 1-[4-(3,5-difluorobenzoyl)-1-oxa-4-azaspiro[4.5]decane-3-carbonyl]piperidine-4-carboxylate
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
V011-4144
Molecular Formula
C24H30F2N2O5 (C24 H30 F2 N2 O5)
Compound Name
ethyl 1-[4-(3,5-difluorobenzoyl)-1-oxa-4-azaspiro[4.5]decane-3-carbonyl]piperidine-4-carboxylate
IUPAC name
ethyl 1-[4-(35-difluorobenzoyl)-1-oxa-4-azaspiro[4.5]decane-3-carbonyl]piperidine-4-carboxylate
SMILES
CCOC(C(CC1)CCN1C(C(COC12CCCCC2)N1C(c1cc(F)cc(F)c1)=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
464.51
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.357
Distribution Coefficient, logD
3.357
Water Solubility, LogSw
-3.35
Polar Surface Area
60.528
Acid Dissociation Constant (pKa)
19.51
Base Dissociation Constant (pKb)
3.75
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
62.50
V011-4144 in Drug Discovery
Included in Screening Libraries
Antiviral Library (67538 compounds)
Anti-HIV1 Library (19540 compounds)
MCE-18 Trends in Medicinal Chemistry (51288 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Agro
References: we are preparing a list of scientific research reports with V011-4144 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)