D149-0036 Screening compound: 2-ethyl-3-(2-furylmethyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one

D149-0036 Screening compound: 2-ethyl-3-(2-furylmethyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
D149-0036 Screening compound: 2-ethyl-3-(2-furylmethyl)-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 D149-0036
2-ethyl-3-(2-furylmethyl)-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

D149-0036

Molecular Formula

C19H21N3O3S (C19 H21 N3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCC(Nc1c2sc3nc(C)cc(COC)c13)N(Cc1ccco1)C2=O

InChI

InChI=1S/C19H21N3O3S/c1-4-14-21-16-15-12(10-24-3)8-11(2)20-18(15)26-17(16)19(23)22(14)9-13-6-5-7-25-13/h5-8,14,21H,4,9-10H2,1-3H3/t14-/m1/s1

InChI Key

XUFDFHIVGUYKCJ-CQSZACIVSA-N

MDL Number (MFCD)

MFCD14812792

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.188

Distribution Coefficient, logD

3.154

Water Solubility, LogSw

-3.38

Polar Surface Area

51.120

Acid Dissociation Constant (pKa)

17.35

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

D149-0036 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D149-0036 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D149-0036?
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What is the minimum amount of D149-0036 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D149-0036
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D149-0036
  • 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 D149-0036 available by request