8014-9111 Screening compound: N-[4-(1H-imidazol-1-yl)-6-(isopropylamino)-1,3,5-triazin-2-yl]-N-methyl-N-phenylamine

8014-9111 Screening compound: N-[4-(1H-imidazol-1-yl)-6-(isopropylamino)-1,3,5-triazin-2-yl]-N-methyl-N-phenylamine
8014-9111 Screening compound: N-[4-(1H-imidazol-1-yl)-6-(isopropylamino)-1,3,5-triazin-2-yl]-N-methyl-N-phenylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9111
N-[4-(1H-imidazol-1-yl)-6-(isopropylamino)-1,3,5-triazin-2-yl]-N-methyl-N-phenylamine

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

8014-9111

Molecular Formula

C16H19N7 (C16 H19 N7)

Compound Name

N-[4-(1H-imidazol-1-yl)-6-(isopropylamino)-1,3,5-triazin-2-yl]-N-methyl-N-phenylamine

IUPAC name

6-(1H-imidazol-1-yl)-N2-methyl-N2-phenyl-N4-(propan-2-yl)-135-triazine-24-diamine

SMILES

CC(C)Nc1nc(-n2cncc2)nc(N(C)c2ccccc2)n1

InChI

InChI=1S/C16H19N7/c1-12(2)18-14-19-15(22(3)13-7-5-4-6-8-13)21-16(20-14)23-10-9-17-11-23/h4-12H,1-3H3,(H,18,19,20,21)

InChI Key

RRKMZKXSSIMTNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03820873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.128

Distribution Coefficient, logD

2.935

Water Solubility, LogSw

-3.03

Polar Surface Area

53.472

Acid Dissociation Constant (pKa)

15.90

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 8014-9111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9111?
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What is the minimum amount of 8014-9111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9111
  • 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 8014-9111 available by request