V030-6085 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide

V030-6085 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide
V030-6085 Screening compound: 2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-6085
2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitro-N-(propan-2-yl)benzene-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

V030-6085

Molecular Formula

C26H31N5O7S (C26 H31 N5 O7 S)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C26H31N5O7S/c1-16(2)28-39(35,36)23-15-20(31(33)34)8-9-22(23)38-26-19(5)24(25(32)29-10-12-37-13-11-29)27-30(26)21-14-17(3)6-7-18(21)4/h6-9,14-16,28H,10-13H2,1-5H3

InChI Key

KWMNPNOVXLRSNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19790747

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

557.63

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

4.050

Water Solubility, LogSw

-4.13

Polar Surface Area

120.055

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

-3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

References: we are preparing a list of scientific research reports with V030-6085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-6085?
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What is the minimum amount of V030-6085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-6085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-6085
  • 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 V030-6085 available by request