3820-6035 Screening compound: 1-(3-ethoxybenzoyl)-3-(4-phenyl-1,3-thiazol-2-yl)thiourea

3820-6035 Screening compound: 1-(3-ethoxybenzoyl)-3-(4-phenyl-1,3-thiazol-2-yl)thiourea
3820-6035 Screening compound: 1-(3-ethoxybenzoyl)-3-(4-phenyl-1,3-thiazol-2-yl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3820-6035
1-(3-ethoxybenzoyl)-3-(4-phenyl-1,3-thiazol-2-yl)thiourea

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

3820-6035

Molecular Formula

C19H17N3O2S2 (C19 H17 N3 O2 S2)

Compound Name

1-(3-ethoxybenzoyl)-3-(4-phenyl-1,3-thiazol-2-yl)thiourea

IUPAC name

1-(3-ethoxybenzoyl)-3-(4-phenyl-13-thiazol-2-yl)thiourea

SMILES

CCOc1cccc(C(NC(Nc2nc(-c3ccccc3)cs2)=S)=O)c1

InChI

InChI=1S/C19H17N3O2S2/c1-2-24-15-10-6-9-14(11-15)17(23)21-18(25)22-19-20-16(12-26-19)13-7-4-3-5-8-13/h3-12H,2H2,1H3,(H2,20,21,22,23,25)

InChI Key

BHJVHSHSSSZNQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02928522

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.357

Distribution Coefficient, logD

5.357

Water Solubility, LogSw

-5.28

Polar Surface Area

50.138

Acid Dissociation Constant (pKa)

11.77

Base Dissociation Constant (pKb)

1.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

3820-6035 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3820-6035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3820-6035?
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What is the minimum amount of 3820-6035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3820-6035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3820-6035
  • 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 3820-6035 available by request