G402-0141 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide

G402-0141 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide
G402-0141 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-3-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G402-0141
N-(2H-1,3-benzodioxol-5-yl)-3-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide

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

G402-0141

Molecular Formula

C19H24N4O5S (C19 H24 N4 O5 S)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-3-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-3-[35-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrazol-1-yl]propanamide

SMILES

Cc(n(CCC(Nc(cc1)cc2c1OCO2)=O)nc1C)c1S(N1CCCC1)(=O)=O

InChI

InChI=1S/C19H24N4O5S/c1-13-19(29(25,26)22-8-3-4-9-22)14(2)23(21-13)10-7-18(24)20-15-5-6-16-17(11-15)28-12-27-16/h5-6,11H,3-4,7-10,12H2,1-2H3,(H,20,24)

InChI Key

NVVVEZLGXYZZGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15009291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.185

Distribution Coefficient, logD

1.185

Water Solubility, LogSw

-2.42

Polar Surface Area

86.840

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

G402-0141 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G402-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G402-0141?
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What is the minimum amount of G402-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G402-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G402-0141
  • 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 G402-0141 available by request