Y031-7505 Screening compound: N,N-diethyl-N-(4-isopropylphenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide

Y031-7505 Screening compound: N,N-diethyl-N-(4-isopropylphenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide
Y031-7505 Screening compound: N,N-diethyl-N-(4-isopropylphenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7505
N,N-diethyl-N-(4-isopropylphenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide

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

Y031-7505

Molecular Formula

C20H31N3O2 (C20 H31 N3 O2)

Compound Name

N,N-diethyl-N-(4-isopropylphenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N1N1-diethyl-N4-[4-(propan-2-yl)phenyl]piperidine-14-dicarboxamide

SMILES

CCN(CC)C(N(CC1)CCC1C(Nc1ccc(C(C)C)cc1)=O)=O

InChI

InChI=1S/C20H31N3O2/c1-5-22(6-2)20(25)23-13-11-17(12-14-23)19(24)21-18-9-7-16(8-10-18)15(3)4/h7-10,15,17H,5-6,11-14H2,1-4H3,(H,21,24)

InChI Key

PRYLNGCIOAKLGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15180351

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.790

Distribution Coefficient, logD

3.790

Water Solubility, LogSw

-3.75

Polar Surface Area

41.067

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

References: we are preparing a list of scientific research reports with Y031-7505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7505?
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What is the minimum amount of Y031-7505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7505
  • 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 Y031-7505 available by request