V027-8688 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide

V027-8688 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide
V027-8688 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-8688
2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide

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

V027-8688

Molecular Formula

C27H33N5O7S (C27 H33 N5 O7 S)

Compound Name

2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide

IUPAC name

2-{[1-(25-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide

SMILES

CC(C)CNS(c(cc(cc1)[N+]([O-])=O)c1Oc1c(C)c(C(N2CCOCC2)=O)nn1-c1c(C)ccc(C)c1)(=O)=O

InChI

InChI=1S/C27H33N5O7S/c1-17(2)16-28-40(36,37)24-15-21(32(34)35)8-9-23(24)39-27-20(5)25(26(33)30-10-12-38-13-11-30)29-31(27)22-14-18(3)6-7-19(22)4/h6-9,14-15,17,28H,10-13,16H2,1-5H3

InChI Key

TXAPOFMAVSSHDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791044

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

571.65

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.678

Distribution Coefficient, logD

4.677

Water Solubility, LogSw

-4.45

Polar Surface Area

120.868

Acid Dissociation Constant (pKa)

10.82

Base Dissociation Constant (pKb)

-3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

References: we are preparing a list of scientific research reports with V027-8688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-8688?
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What is the minimum amount of V027-8688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-8688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-8688
  • 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 V027-8688 available by request