V027-8676 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide

V027-8676 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide
V027-8676 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-8676
2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(pyrrolidine-1-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

V027-8676

Molecular Formula

C27H33N5O6S (C27 H33 N5 O6 S)

Compound Name

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

IUPAC name

2-{[1-(25-dimethylphenyl)-4-methyl-3-(pyrrolidine-1-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(N2CCCC2)=O)nn1-c1c(C)ccc(C)c1)(=O)=O

InChI

InChI=1S/C27H33N5O6S/c1-17(2)16-28-39(36,37)24-15-21(32(34)35)10-11-23(24)38-27-20(5)25(26(33)30-12-6-7-13-30)29-31(27)22-14-18(3)8-9-19(22)4/h8-11,14-15,17,28H,6-7,12-13,16H2,1-5H3

InChI Key

FMURUHHXCFBHNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791034

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

555.66

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.549

Distribution Coefficient, logD

5.549

Water Solubility, LogSw

-5.37

Polar Surface Area

113.325

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 V027-8676 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-8676?
Check Price and Availability of V027-8676, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V027-8676 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-8676
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-8676
  • 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 V027-8676 available by request