D364-1685 Screening compound: 5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

D364-1685 Screening compound: 5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
D364-1685 Screening compound: 5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-1685
5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-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

D364-1685

Molecular Formula

C19H22N4O5S (C19 H22 N4 O5 S)

Compound Name

5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

IUPAC name

5-[5-(25-dimethoxyphenyl)-1-propanoyl-45-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-methyl-2-sulfanylidene-1234-tetrahydropyrimidin-4-one

SMILES

CCC(N(C(C1)c(cc(cc2)OC)c2OC)N=C1C(C(N(C)C(N1)=S)=O)=C1O)=O

InChI

InChI=1S/C19H22N4O5S/c1-5-15(24)23-13(11-8-10(27-3)6-7-14(11)28-4)9-12(21-23)16-17(25)20-19(29)22(2)18(16)26/h6-8,13,25H,5,9H2,1-4H3,(H,20,29)/t13-/m1/s1

InChI Key

YUIUGEKRKCXISY-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD14825262

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.723

Distribution Coefficient, logD

-2.260

Water Solubility, LogSw

-2.52

Polar Surface Area

85.320

Acid Dissociation Constant (pKa)

3.42

Base Dissociation Constant (pKb)

0.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

References: we are preparing a list of scientific research reports with D364-1685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-1685?
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What is the minimum amount of D364-1685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-1685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-1685
  • 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 D364-1685 available by request