P392-1701 Screening compound: 2-{[1-(4-isopropoxybenzoyl)tetrahydro-1H-pyrrol-3-yl]oxy}-N~3~,N~3~-dimethylnicotinamide

P392-1701 Screening compound: 2-{[1-(4-isopropoxybenzoyl)tetrahydro-1H-pyrrol-3-yl]oxy}-N~3~,N~3~-dimethylnicotinamide
P392-1701 Screening compound: 2-{[1-(4-isopropoxybenzoyl)tetrahydro-1H-pyrrol-3-yl]oxy}-N~3~,N~3~-dimethylnicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P392-1701
2-{[1-(4-isopropoxybenzoyl)tetrahydro-1H-pyrrol-3-yl]oxy}-N~3~,N~3~-dimethylnicotinamide

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

P392-1701

Molecular Formula

C22H27N3O4 (C22 H27 N3 O4)

Compound Name

2-{[1-(4-isopropoxybenzoyl)tetrahydro-1H-pyrrol-3-yl]oxy}-N~3~,N~3~-dimethylnicotinamide

IUPAC name

NN-dimethyl-2-({1-[4-(propan-2-yloxy)benzoyl]pyrrolidin-3-yl}oxy)pyridine-3-carboxamide

SMILES

CC(C)Oc(cc1)ccc1C(N(CC1)CC1Oc1ncccc1C(N(C)C)=O)=O

InChI

InChI=1S/C22H27N3O4/c1-15(2)28-17-9-7-16(8-10-17)21(26)25-13-11-18(14-25)29-20-19(6-5-12-23-20)22(27)24(3)4/h5-10,12,15,18H,11,13-14H2,1-4H3/t18-/m1/s1

InChI Key

SGAKFJSJBLVOHT-GOSISDBHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.612

Distribution Coefficient, logD

1.612

Water Solubility, LogSw

-2.07

Polar Surface Area

56.056

Acid Dissociation Constant (pKa)

25.07

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.91

P392-1701 in Drug Discovery

Included in Screening Libraries

Ligand-Gated Ion Channels Library (3887 compounds)

PI3K-Targeted Library (17255 compounds)

MEF2-HDAC (class II) Modulators Library (5147 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Eye
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Ion Channels
  • Kinases
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with P392-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P392-1701?
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What is the minimum amount of P392-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P392-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P392-1701
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P392-1701 available by request