G892-0301 Screening compound: ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate

G892-0301 Screening compound: ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
G892-0301 Screening compound: ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G892-0301
ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate

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

G892-0301

Molecular Formula

C21H29N5O3 (C21 H29 N5 O3)

Compound Name

ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate

IUPAC name

ethyl 5-amino-1-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate

SMILES

CCOC(c1c(N)n(-c(cc2)ccc2C(NCCC(C)N2CCCC2)=O)nc1)=O

InChI

InChI=1S/C21H29N5O3/c1-3-29-21(28)18-14-24-26(19(18)22)17-8-6-16(7-9-17)20(27)23-11-10-15(2)25-12-4-5-13-25/h6-9,14-15H,3-5,10-13,22H2,1-2H3,(H,23,27)/t15-/m0/s1

InChI Key

MSEAVFWXBKBNQA-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD15073601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.922

Distribution Coefficient, logD

-1.473

Water Solubility, LogSw

-2.57

Polar Surface Area

82.570

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

10.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.60

G892-0301 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G892-0301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G892-0301?
Check Price and Availability of G892-0301, 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 G892-0301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G892-0301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G892-0301
  • 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 G892-0301 available by request