8018-7763 Screening compound: 6-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2,N2-dimethyl-1,3,5-triazine-2,4-diamine

8018-7763 Screening compound: 6-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2,N2-dimethyl-1,3,5-triazine-2,4-diamine
8018-7763 Screening compound: 6-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2,N2-dimethyl-1,3,5-triazine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-7763
6-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2,N2-dimethyl-1,3,5-triazine-2,4-diamine

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

8018-7763

Molecular Formula

C11H16N8O2 (C11 H16 N8 O2)

Compound Name

6-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2,N2-dimethyl-1,3,5-triazine-2,4-diamine

IUPAC name

6-[(35-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N2N2-dimethyl-135-triazine-24-diamine

SMILES

Cc(n(Cc1nc(N(C)C)nc(N)n1)nc1C)c1[N+]([O-])=O

InChI

InChI=1S/C11H16N8O2/c1-6-9(19(20)21)7(2)18(16-6)5-8-13-10(12)15-11(14-8)17(3)4/h5H2,1-4H3,(H2,12,13,14,15)

InChI Key

DOTSXCGUWTXIFP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08532215

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.511

Distribution Coefficient, logD

0.480

Water Solubility, LogSw

-0.49

Polar Surface Area

100.355

Acid Dissociation Constant (pKa)

17.68

Base Dissociation Constant (pKb)

6.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

8018-7763 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 8018-7763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-7763?
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What is the minimum amount of 8018-7763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-7763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-7763
  • 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 8018-7763 available by request