7100-1045 Screening compound: N1,N1-diethyl-N4-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzene-1,4-diamine

7100-1045 Screening compound: N1,N1-diethyl-N4-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzene-1,4-diamine
7100-1045 Screening compound: N1,N1-diethyl-N4-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzene-1,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7100-1045
N1,N1-diethyl-N4-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzene-1,4-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

7100-1045

Molecular Formula

C18H20N4S (C18 H20 N4 S)

Compound Name

N1,N1-diethyl-N4-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzene-1,4-diamine

IUPAC name

N1N1-diethyl-N4-[4-(pyridin-2-yl)-13-thiazol-2-yl]benzene-14-diamine

SMILES

CCN(CC)c(cc1)ccc1Nc1nc(-c2ncccc2)cs1

InChI

InChI=1S/C18H20N4S/c1-3-22(4-2)15-10-8-14(9-11-15)20-18-21-17(13-23-18)16-7-5-6-12-19-16/h5-13H,3-4H2,1-2H3,(H,20,21)

InChI Key

ALRMSYIIXKAFEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02045268

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.788

Distribution Coefficient, logD

4.552

Water Solubility, LogSw

-4.50

Polar Surface Area

30.710

Acid Dissociation Constant (pKa)

19.98

Base Dissociation Constant (pKb)

9.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

7100-1045 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 7100-1045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7100-1045?
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What is the minimum amount of 7100-1045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7100-1045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7100-1045
  • 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 7100-1045 available by request