Y031-7535 Screening compound: N,N-diethyl-N-(2-{[(tetrahydro-2-furanylmethyl)amino]carbonyl}phenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide

Y031-7535 Screening compound: N,N-diethyl-N-(2-{[(tetrahydro-2-furanylmethyl)amino]carbonyl}phenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide
Y031-7535 Screening compound: N,N-diethyl-N-(2-{[(tetrahydro-2-furanylmethyl)amino]carbonyl}phenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-7535
N,N-diethyl-N-(2-{[(tetrahydro-2-furanylmethyl)amino]carbonyl}phenyl)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

Y031-7535

Molecular Formula

C23H34N4O4 (C23 H34 N4 O4)

Compound Name

N,N-diethyl-N-(2-{[(tetrahydro-2-furanylmethyl)amino]carbonyl}phenyl)tetrahydro-1,4(2H)-pyridinedicarboxamide

IUPAC name

N1N1-diethyl-N4-(2-{[(oxolan-2-yl)methyl]carbamoyl}phenyl)piperidine-14-dicarboxamide

SMILES

CCN(CC)C(N(CC1)CCC1C(Nc(cccc1)c1C(NCC1OCCC1)=O)=O)=O

InChI

InChI=1S/C23H34N4O4/c1-3-26(4-2)23(30)27-13-11-17(12-14-27)21(28)25-20-10-6-5-9-19(20)22(29)24-16-18-8-7-15-31-18/h5-6,9-10,17-18H,3-4,7-8,11-16H2,1-2H3,(H,24,29)(H,25,28)/t18-/m1/s1

InChI Key

BZOKNSWEUBCUBW-GOSISDBHSA-N

MDL Number (MFCD)

MFCD15180466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.826

Distribution Coefficient, logD

1.823

Water Solubility, LogSw

-2.50

Polar Surface Area

73.437

Acid Dissociation Constant (pKa)

9.70

Base Dissociation Constant (pKb)

2.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.87

References: we are preparing a list of scientific research reports with Y031-7535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-7535?
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What is the minimum amount of Y031-7535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-7535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-7535
  • 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 Y031-7535 available by request