1306-0028 Screening compound: N,N,1-trimethyl-4-nitro-1H-pyrazole-5-carboxamide

1306-0028 Screening compound: N,N,1-trimethyl-4-nitro-1H-pyrazole-5-carboxamide
1306-0028 Screening compound: N,N,1-trimethyl-4-nitro-1H-pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1306-0028
N,N,1-trimethyl-4-nitro-1H-pyrazole-5-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

1306-0028

Molecular Formula

C7H10N4O3 (C7 H10 N4 O3)

Compound Name

N,N,1-trimethyl-4-nitro-1H-pyrazole-5-carboxamide

IUPAC name

NN1-trimethyl-4-nitro-1H-pyrazole-5-carboxamide

SMILES

CN(C)C(c(n(C)nc1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C7H10N4O3/c1-9(2)7(12)6-5(11(13)14)4-8-10(6)3/h4H,1-3H3

InChI Key

ATBCUZLHPUHKAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00464014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

198.18

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.795

Distribution Coefficient, logD

-0.795

Water Solubility, LogSw

-0.39

Polar Surface Area

62.835

Acid Dissociation Constant (pKa)

31.31

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

1306-0028 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1306-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1306-0028?
Check Price and Availability of 1306-0028, 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 1306-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1306-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1306-0028
  • 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 1306-0028 available by request