P114-1508 Screening compound: 4-(1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N~1~-(tetrahydro-2-furanylmethyl)-3,6-dihydro-1(2H)-pyridinecarboxamide
Chemical Structure Depiction of ChemDiv screening compound P114-1508
4-(1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N~1~-(tetrahydro-2-furanylmethyl)-3,6-dihydro-1(2H)-pyridinecarboxamide
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
P114-1508
Molecular Formula
C21H28N4O2 (C21 H28 N4 O2)
Compound Name
4-(1-propyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-N~1~-(tetrahydro-2-furanylmethyl)-3,6-dihydro-1(2H)-pyridinecarboxamide
IUPAC name
n/a
SMILES
CCCn1c(nccc2)c2c(C(CC2)=CCN2C(NCC2OCCC2)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
368.48
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.340
Distribution Coefficient, logD
2.339
Water Solubility, LogSw
-2.73
Polar Surface Area
47.301
Acid Dissociation Constant (pKa)
15.53
Base Dissociation Constant (pKb)
4.45
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
52.40
P114-1508 in Drug Discovery
Included in Screening Libraries
DGK Inhibitors Library (10558 compounds)
Hsp90-Targeted Library (11355 compounds)
Protein-Protein Interaction Library (218420 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Epigenetics Focused Set (26518 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Hemic and lymphatic
- Skin
- Metabolic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Kinases
- PPI modulators
- Cyclic compounds
- Agro
References: we are preparing a list of scientific research reports with P114-1508 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)