P634-0209 Screening compound: 3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}-N-[(3-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of ChemDiv screening compound P634-0209
3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}-N-[(3-methoxyphenyl)methyl]propanamide
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
P634-0209
Molecular Formula
C22H31N5O2 (C22 H31 N5 O2)
Compound Name
3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}-N-[(3-methoxyphenyl)methyl]propanamide
IUPAC name
3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl}-N-[(3-methoxyphenyl)methyl]propanamide
SMILES
CCNc1cc(N2CC(CCC(NCc3cc(OC)ccc3)=O)CCC2)ncn1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
397.52
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.586
Distribution Coefficient, logD
3.574
Water Solubility, LogSw
-3.81
Polar Surface Area
65.340
Acid Dissociation Constant (pKa)
13.51
Base Dissociation Constant (pKb)
5.84
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
50.00
P634-0209 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with P634-0209 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)