G013-0319 Screening compound: N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide

G013-0319 Screening compound: N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
G013-0319 Screening compound: N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G013-0319
N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-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

G013-0319

Molecular Formula

C23H31N5O (C23 H31 N5 O)

Compound Name

N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide

IUPAC name

N-[2-(dipropylamino)ethyl]-1-(3-methylphenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide

SMILES

CCCN(CCC)CCNC(c1c(-n2cccc2)n(-c2cc(C)ccc2)nc1)=O

InChI

InChI=1S/C23H31N5O/c1-4-12-26(13-5-2)16-11-24-22(29)21-18-25-28(20-10-8-9-19(3)17-20)23(21)27-14-6-7-15-27/h6-10,14-15,17-18H,4-5,11-13,16H2,1-3H3,(H,24,29)

InChI Key

VZPBWTPCLNFAAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14976576

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.054

Distribution Coefficient, logD

3.905

Water Solubility, LogSw

-4.33

Polar Surface Area

45.540

Acid Dissociation Constant (pKa)

14.44

Base Dissociation Constant (pKb)

8.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

G013-0319 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G013-0319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G013-0319?
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What is the minimum amount of G013-0319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G013-0319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G013-0319
  • 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 G013-0319 available by request