D364-1092 Screening compound: 5-[1-acetyl-5-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

D364-1092 Screening compound: 5-[1-acetyl-5-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one
D364-1092 Screening compound: 5-[1-acetyl-5-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D364-1092
5-[1-acetyl-5-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethyl-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

D364-1092

Molecular Formula

C20H24N4O6S (C20 H24 N4 O6 S)

Compound Name

5-[1-acetyl-5-(2,3,4-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

IUPAC name

5-[1-acetyl-5-(234-trimethoxyphenyl)-45-dihydro-1H-pyrazol-3-yl]-6-hydroxy-13-dimethyl-2-sulfanylidene-1234-tetrahydropyrimidin-4-one

SMILES

CC(N(C(C1)c(ccc(OC)c2OC)c2OC)N=C1C(C(N(C)C(N1C)=S)=O)=C1O)=O

InChI

InChI=1S/C20H24N4O6S/c1-10(25)24-13(11-7-8-14(28-4)17(30-6)16(11)29-5)9-12(21-24)15-18(26)22(2)20(31)23(3)19(15)27/h7-8,13,26H,9H2,1-6H3/t13-/m1/s1

InChI Key

UJCPMMXPYDGMQV-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD14825208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.839

Distribution Coefficient, logD

-2.321

Water Solubility, LogSw

-1.88

Polar Surface Area

85.585

Acid Dissociation Constant (pKa)

4.24

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

D364-1092 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with D364-1092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D364-1092?
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What is the minimum amount of D364-1092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D364-1092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D364-1092
  • 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 D364-1092 available by request