V019-9832 Screening compound: 3-cyclopentyl-1-{4-[6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of ChemDiv screening compound V019-9832
3-cyclopentyl-1-{4-[6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
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
V019-9832
Molecular Formula
C28H34F3N5O2 (C28 H34 F3 N5 O2)
Compound Name
3-cyclopentyl-1-{4-[6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl]-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
IUPAC name
3-cyclopentyl-1-{4-[6-(2-methylpropyl)-3-[3-(trifluoromethyl)phenyl]-[12]oxazolo[54-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
SMILES
CC(C)Cc1nc(N(CC2)CCN2C(CCC2CCCC2)=O)c(c(-c2cccc(C(F)(F)F)c2)no2)c2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
529.61
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
6.548
Distribution Coefficient, logD
6.547
Water Solubility, LogSw
-6.11
Polar Surface Area
61.773
Acid Dissociation Constant (pKa)
21.68
Base Dissociation Constant (pKb)
4.53
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
57.10
V019-9832 in Drug Discovery
Included in Screening Libraries
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with V019-9832 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)