D430-2210 Screening compound: 1-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)-3-[2-(trifluoromethyl)phenyl]urea
Chemical Structure Depiction of ChemDiv screening compound D430-2210
1-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)-3-[2-(trifluoromethyl)phenyl]urea
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
D430-2210
Molecular Formula
C24H25F3N6O (C24 H25 F3 N6 O)
Compound Name
1-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)-3-[2-(trifluoromethyl)phenyl]urea
IUPAC name
1-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)-3-[2-(trifluoromethyl)phenyl]urea
SMILES
Cc1nc(N2CCCCC2)cc(Nc(cc2)ccc2NC(Nc2c(C(F)(F)F)cccc2)=O)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
470.5
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
6.211
Distribution Coefficient, logD
5.654
Water Solubility, LogSw
-5.39
Polar Surface Area
62.423
Acid Dissociation Constant (pKa)
13.20
Base Dissociation Constant (pKb)
7.82
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.20
D430-2210 in Drug Discovery
Included in Screening Libraries
Lipid Metabolism Library (9174 compounds)
Aurora A-B Kinases Targeted Library (9426 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Metabolic
- Cancer
- Digestive system
- Male
- Female
- Hemic and lymphatic
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Kinases
- Phosphatases
References: we are preparing a list of scientific research reports with D430-2210 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)