F853-0693 Screening compound: N-(3,5-DIMETHOXYPHENYL)-N-[6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDIN-2-YL]AMINE

F853-0693 Screening compound: N-(3,5-DIMETHOXYPHENYL)-N-[6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDIN-2-YL]AMINE
F853-0693 Screening compound: N-(3,5-DIMETHOXYPHENYL)-N-[6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDIN-2-YL]AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound F853-0693
N-(3,5-DIMETHOXYPHENYL)-N-[6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDIN-2-YL]AMINE

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

F853-0693

Molecular Formula

C21H22N4O4S (C21 H22 N4 O4 S)

Compound Name

N-(3,5-DIMETHOXYPHENYL)-N-[6-(PHENYLSULFONYL)-5,6,7,8-TETRAHYDROPYRIDO[4,3-D]PYRIMIDIN-2-YL]AMINE

IUPAC name

n/a

SMILES

COc1cc(Nc2nc(CCN(C3)S(c4ccccc4)(=O)=O)c3cn2)cc(OC)c1

InChI

InChI=1S/C21H22N4O4S/c1-28-17-10-16(11-18(12-17)29-2)23-21-22-13-15-14-25(9-8-20(15)24-21)30(26,27)19-6-4-3-5-7-19/h3-7,10-13H,8-9,14H2,1-2H3,(H,22,23,24)

InChI Key

AMJANKKOIZJICN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27200023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.418

Distribution Coefficient, logD

3.418

Water Solubility, LogSw

-3.75

Polar Surface Area

77.339

Acid Dissociation Constant (pKa)

16.35

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

F853-0693 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F853-0693 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F853-0693?
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What is the minimum amount of F853-0693 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F853-0693
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F853-0693
  • 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 F853-0693 available by request