8017-6377 Screening compound: 5-methyl-1-(3-methylbenzyl)-1H-pyrazol-3-amine

8017-6377 Screening compound: 5-methyl-1-(3-methylbenzyl)-1H-pyrazol-3-amine
8017-6377 Screening compound: 5-methyl-1-(3-methylbenzyl)-1H-pyrazol-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-6377
5-methyl-1-(3-methylbenzyl)-1H-pyrazol-3-amine

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

8017-6377

Molecular Formula

C12H15N3 (C12 H15 N3)

Compound Name

5-methyl-1-(3-methylbenzyl)-1H-pyrazol-3-amine

IUPAC name

5-methyl-1-[(3-methylphenyl)methyl]-1H-pyrazol-3-amine

SMILES

Cc1cc(N)nn1Cc1cc(C)ccc1

InChI

InChI=1S/C12H15N3/c1-9-4-3-5-11(6-9)8-15-10(2)7-12(13)14-15/h3-7H,8H2,1-2H3,(H2,13,14)

InChI Key

DIJRRLXCLXOSAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04971118

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

201.27

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.176

Distribution Coefficient, logD

2.168

Water Solubility, LogSw

-2.01

Polar Surface Area

34.803

Acid Dissociation Constant (pKa)

18.74

Base Dissociation Constant (pKb)

5.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8017-6377 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with 8017-6377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-6377?
Check Price and Availability of 8017-6377, 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 8017-6377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-6377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-6377
  • 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 8017-6377 available by request