D148-5060 Screening compound: 3-(2-ethylphenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one

D148-5060 Screening compound: 3-(2-ethylphenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
D148-5060 Screening compound: 3-(2-ethylphenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D148-5060
3-(2-ethylphenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one

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

D148-5060

Molecular Formula

C20H21N3O2S (C20 H21 N3 O2 S)

Compound Name

3-(2-ethylphenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one

IUPAC name

5-(2-ethylphenyl)-13-(methoxymethyl)-11-methyl-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)911-tetraen-6-one

SMILES

CCc(cccc1)c1N(CNc1c2sc3nc(C)cc(COC)c13)C2=O

InChI

InChI=1S/C20H21N3O2S/c1-4-13-7-5-6-8-15(13)23-11-21-17-16-14(10-25-3)9-12(2)22-19(16)26-18(17)20(23)24/h5-9,21H,4,10-11H2,1-3H3

InChI Key

DFUKAPVPZKXXLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.790

Distribution Coefficient, logD

3.789

Water Solubility, LogSw

-4.00

Polar Surface Area

42.021

Acid Dissociation Constant (pKa)

14.77

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D148-5060 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 D148-5060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D148-5060?
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What is the minimum amount of D148-5060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D148-5060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D148-5060
  • 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 D148-5060 available by request