4052-1385 Screening compound: (2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine

4052-1385 Screening compound: (2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine
4052-1385 Screening compound: (2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4052-1385
(2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine

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

4052-1385

Molecular Formula

C21H25N3S (C21 H25 N3 S)

Compound Name

(2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-2,3-dihydro-1,3-thiazol-2-imine

IUPAC name

(2Z)-3-[3-(dimethylamino)propyl]-4-(4-methylphenyl)-N-phenyl-23-dihydro-13-thiazol-2-imine

SMILES

Cc(cc1)ccc1C(N1CCCN(C)C)=CS/C1=N\c1ccccc1

InChI

InChI=1S/C21H25N3S/c1-17-10-12-18(13-11-17)20-16-25-21(22-19-8-5-4-6-9-19)24(20)15-7-14-23(2)3/h4-6,8-13,16H,7,14-15H2,1-3H3

InChI Key

UQIPCZJEOAPVJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02986129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.52

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.718

Distribution Coefficient, logD

3.086

Water Solubility, LogSw

-4.44

Polar Surface Area

15.419

Acid Dissociation Constant (pKa)

27.23

Base Dissociation Constant (pKb)

9.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 4052-1385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4052-1385?
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What is the minimum amount of 4052-1385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4052-1385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4052-1385
  • 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 4052-1385 available by request