8017-4027 Screening compound: 4-(4-isopropyl-2,3-dimethyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-N~1~-propyl-1-benzenesulfonamide

8017-4027 Screening compound: 4-(4-isopropyl-2,3-dimethyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-N~1~-propyl-1-benzenesulfonamide
8017-4027 Screening compound: 4-(4-isopropyl-2,3-dimethyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-N~1~-propyl-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-4027
4-(4-isopropyl-2,3-dimethyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-N~1~-propyl-1-benzenesulfonamide

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

8017-4027

Molecular Formula

C17H25N3O3S (C17 H25 N3 O3 S)

Compound Name

4-(4-isopropyl-2,3-dimethyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-N~1~-propyl-1-benzenesulfonamide

IUPAC name

4-[23-dimethyl-5-oxo-4-(propan-2-yl)-25-dihydro-1H-pyrazol-1-yl]-N-propylbenzene-1-sulfonamide

SMILES

CCCNS(c(cc1)ccc1N1N(C)C(C)=C(C(C)C)C1=O)(=O)=O

InChI

InChI=1S/C17H25N3O3S/c1-6-11-18-24(22,23)15-9-7-14(8-10-15)20-17(21)16(12(2)3)13(4)19(20)5/h7-10,12,18H,6,11H2,1-5H3

InChI Key

DVIWWUCCAHOBHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06016560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.202

Distribution Coefficient, logD

2.202

Water Solubility, LogSw

-2.83

Polar Surface Area

62.292

Acid Dissociation Constant (pKa)

11.18

Base Dissociation Constant (pKb)

2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.06

References: we are preparing a list of scientific research reports with 8017-4027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-4027?
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What is the minimum amount of 8017-4027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-4027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-4027
  • 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 8017-4027 available by request