8019-3880 Screening compound: N-{4-amino-6-[(dibenzo[b,d]furan-2-yloxy)methyl]-1,3,5-triazin-2-yl}-N,N-dimethylamine

8019-3880 Screening compound: N-{4-amino-6-[(dibenzo[b,d]furan-2-yloxy)methyl]-1,3,5-triazin-2-yl}-N,N-dimethylamine
8019-3880 Screening compound: N-{4-amino-6-[(dibenzo[b,d]furan-2-yloxy)methyl]-1,3,5-triazin-2-yl}-N,N-dimethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3880
N-{4-amino-6-[(dibenzo[b,d]furan-2-yloxy)methyl]-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

8019-3880

Molecular Formula

C18H17N5O2 (C18 H17 N5 O2)

Compound Name

N-{4-amino-6-[(dibenzo[b,d]furan-2-yloxy)methyl]-1,3,5-triazin-2-yl}-N,N-dimethylamine

IUPAC name

N2N2-dimethyl-6-({8-oxatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-4-yloxy}methyl)-135-triazine-24-diamine

SMILES

CN(C)c1nc(N)nc(COc(cc2)cc3c2oc2c3cccc2)n1

InChI

InChI=1S/C18H17N5O2/c1-23(2)18-21-16(20-17(19)22-18)10-24-11-7-8-15-13(9-11)12-5-3-4-6-14(12)25-15/h3-9H,10H2,1-2H3,(H2,19,20,21,22)

InChI Key

BSIXQLWDKXWZMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09064680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.893

Distribution Coefficient, logD

3.893

Water Solubility, LogSw

-4.21

Polar Surface Area

68.436

Acid Dissociation Constant (pKa)

17.34

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

8019-3880 in Drug Discovery

Included in Screening Libraries

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-3880 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3880?
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What is the minimum amount of 8019-3880 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3880
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3880
  • 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 8019-3880 available by request