V030-7539 Screening compound: N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide

V030-7539 Screening compound: N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide
V030-7539 Screening compound: N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-7539
N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide

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

V030-7539

Molecular Formula

C25H30ClN5O6S (C25 H30 ClN5 O6 S)

Compound Name

N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide

IUPAC name

N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(3-chlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide

SMILES

CCC(C)NC(c(c(C)c1Oc(ccc([N+]([O-])=O)c2)c2S(NC(C)CC)(=O)=O)nn1-c1cccc(Cl)c1)=O

InChI

InChI=1S/C25H30ClN5O6S/c1-6-15(3)27-24(32)23-17(5)25(30(28-23)19-10-8-9-18(26)13-19)37-21-12-11-20(31(33)34)14-22(21)38(35,36)29-16(4)7-2/h8-16,29H,6-7H2,1-5H3,(H,27,32)

InChI Key

PNCLGTVZAQXTAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791023

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

564.06

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.020

Distribution Coefficient, logD

5.020

Water Solubility, LogSw

-5.06

Polar Surface Area

120.393

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-1.45

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.00

References: we are preparing a list of scientific research reports with V030-7539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-7539?
Check Price and Availability of V030-7539, 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 V030-7539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-7539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-7539
  • 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 V030-7539 available by request