C352-0002 Screening compound: 4,4-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1,2,3,4-tetrahydropyrimidine-2-thione

C352-0002 Screening compound: 4,4-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1,2,3,4-tetrahydropyrimidine-2-thione
C352-0002 Screening compound: 4,4-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1,2,3,4-tetrahydropyrimidine-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound C352-0002
4,4-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1,2,3,4-tetrahydropyrimidine-2-thione

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

C352-0002

Molecular Formula

C15H18N2S2 (C15 H18 N2 S2)

Compound Name

4,4-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1,2,3,4-tetrahydropyrimidine-2-thione

IUPAC name

44-dimethyl-6-[(1E)-2-[4-(methylsulfanyl)phenyl]ethenyl]-1234-tetrahydropyrimidine-2-thione

SMILES

CC(C)(C=C(/C=C/c(cc1)ccc1SC)N1)NC1=S

InChI

InChI=1S/C15H18N2S2/c1-15(2)10-12(16-14(18)17-15)7-4-11-5-8-13(19-3)9-6-11/h4-10H,1-3H3,(H2,16,17,18)

InChI Key

QLRZMCSOEDCYCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14750902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.382

Distribution Coefficient, logD

4.382

Water Solubility, LogSw

-4.38

Polar Surface Area

22.616

Acid Dissociation Constant (pKa)

14.83

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with C352-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C352-0002?
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What is the minimum amount of C352-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C352-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C352-0002
  • 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 C352-0002 available by request