V019-3154 Screening compound: 5-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-(trifluoromethyl)pyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound V019-3154
5-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-(trifluoromethyl)pyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]furan-2-carboxamide
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
V019-3154
Molecular Formula
C27H27F3N4O5S (C27 H27 F3 N4 O5 S)
Compound Name
5-{[(4-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-6-(trifluoromethyl)pyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]furan-2-carboxamide
IUPAC name
5-{[(4-{[2-(34-dimethoxyphenyl)ethyl](methyl)amino}-6-(trifluoromethyl)pyrimidin-2-yl)sulfanyl]methyl}-N-[(furan-2-yl)methyl]furan-2-carboxamide
SMILES
CN(CCc(cc1)cc(OC)c1OC)c1cc(C(F)(F)F)nc(SCc2ccc(C(NCc3ccco3)=O)o2)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
576.6
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
14.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
5.569
Distribution Coefficient, logD
5.569
Water Solubility, LogSw
-5.39
Polar Surface Area
74.921
Acid Dissociation Constant (pKa)
12.15
Base Dissociation Constant (pKb)
1.71
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.60
V019-3154 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Included in 1.7M Stock Database
- Cancer
References: we are preparing a list of scientific research reports with V019-3154 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)