G869-0123 Screening compound: N~1~-{4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl}-3,4,5-trimethoxybenzamide

G869-0123 Screening compound: N~1~-{4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl}-3,4,5-trimethoxybenzamide
G869-0123 Screening compound: N~1~-{4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl}-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G869-0123
N~1~-{4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl}-3,4,5-trimethoxybenzamide

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

G869-0123

Molecular Formula

C27H27N5O4 (C27 H27 N5 O4)

Compound Name

N~1~-{4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl}-3,4,5-trimethoxybenzamide

IUPAC name

345-trimethoxy-N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)benzamide

SMILES

Cc1nc(Nc(cc2)ccc2NC(c(cc2OC)cc(OC)c2OC)=O)nc(Nc2ccccc2)c1

InChI

InChI=1S/C27H27N5O4/c1-17-14-24(29-19-8-6-5-7-9-19)32-27(28-17)31-21-12-10-20(11-13-21)30-26(33)18-15-22(34-2)25(36-4)23(16-18)35-3/h5-16H,1-4H3,(H,30,33)(H2,28,29,31,32)

InChI Key

FYYPMGMRLABCTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09238309

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.103

Distribution Coefficient, logD

4.253

Water Solubility, LogSw

-4.95

Polar Surface Area

84.211

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.81

References: we are preparing a list of scientific research reports with G869-0123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G869-0123?
Check Price and Availability of G869-0123, 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 G869-0123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G869-0123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G869-0123
  • 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 G869-0123 available by request