8014-1272 Screening compound: N-[4-amino-6-(1H-imidazol-1-ylmethyl)-1,3,5-triazin-2-yl]-N,N-dimethylamine

8014-1272 Screening compound: N-[4-amino-6-(1H-imidazol-1-ylmethyl)-1,3,5-triazin-2-yl]-N,N-dimethylamine
8014-1272 Screening compound: N-[4-amino-6-(1H-imidazol-1-ylmethyl)-1,3,5-triazin-2-yl]-N,N-dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-1272
N-[4-amino-6-(1H-imidazol-1-ylmethyl)-1,3,5-triazin-2-yl]-N,N-dimethylamine

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

8014-1272

Molecular Formula

C9H13N7 (C9 H13 N7)

Compound Name

N-[4-amino-6-(1H-imidazol-1-ylmethyl)-1,3,5-triazin-2-yl]-N,N-dimethylamine

IUPAC name

6-[(1H-imidazol-1-yl)methyl]-N2N2-dimethyl-135-triazine-24-diamine

SMILES

CN(C)c1nc(N)nc(Cn2cncc2)n1

InChI

InChI=1S/C9H13N7/c1-15(2)9-13-7(12-8(10)14-9)5-16-4-3-11-6-16/h3-4,6H,5H2,1-2H3,(H2,10,12,13,14)

InChI Key

RXZROPFOOJMIMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03767581

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

219.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.071

Distribution Coefficient, logD

-1.283

Water Solubility, LogSw

0.04

Polar Surface Area

65.844

Acid Dissociation Constant (pKa)

17.76

Base Dissociation Constant (pKb)

8.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

8014-1272 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8014-1272 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-1272?
Check Price and Availability of 8014-1272, 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 8014-1272 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-1272
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-1272
  • 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 8014-1272 available by request