1497-0470 Screening compound: ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

1497-0470 Screening compound: ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylate
1497-0470 Screening compound: ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1497-0470
ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

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

1497-0470

Molecular Formula

C16H20N2O2S (C16 H20 N2 O2 S)

Compound Name

ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

IUPAC name

ethyl 2-(ethylsulfanyl)-4-methyl-6-phenyl-16-dihydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c1ccccc1)N1)=C(C)N=C1SCC)=O

InChI

InChI=1S/C16H20N2O2S/c1-4-20-15(19)13-11(3)17-16(21-5-2)18-14(13)12-9-7-6-8-10-12/h6-10,14H,4-5H2,1-3H3,(H,17,18)/t14-/m1/s1

InChI Key

GBMVUXACCZUCSA-CQSZACIVSA-N

MDL Number (MFCD)

MFCD00183923

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.131

Distribution Coefficient, logD

2.888

Water Solubility, LogSw

-3.16

Polar Surface Area

42.097

Acid Dissociation Constant (pKa)

9.24

Base Dissociation Constant (pKb)

7.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

1497-0470 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1497-0470 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1497-0470?
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What is the minimum amount of 1497-0470 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1497-0470
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1497-0470
  • 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 1497-0470 available by request