F018-3888 Screening compound: 1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one

F018-3888 Screening compound: 1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one
F018-3888 Screening compound: 1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F018-3888
1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-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

F018-3888

Molecular Formula

C19H17BrN2O2S (C19 H17 BrN2 O2 S)

Compound Name

1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-5-yl]ethan-1-one

IUPAC name

1-[4-(5-bromo-2-methoxyphenyl)-6-phenyl-2-sulfanylidene-1234-tetrahydropyrimidin-5-yl]ethan-1-one

SMILES

CC(C(C(c(cc(cc1)Br)c1OC)N1)=C(c2ccccc2)NC1=S)=O

InChI

InChI=1S/C19H17BrN2O2S/c1-11(23)16-17(12-6-4-3-5-7-12)21-19(25)22-18(16)14-10-13(20)8-9-15(14)24-2/h3-10,18H,1-2H3,(H2,21,22,25)/t18-/m0/s1

InChI Key

LSIPROADVZJENO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD03271413

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.054

Distribution Coefficient, logD

3.963

Water Solubility, LogSw

-4.21

Polar Surface Area

44.361

Acid Dissociation Constant (pKa)

8.03

Base Dissociation Constant (pKb)

-9.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with F018-3888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F018-3888?
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What is the minimum amount of F018-3888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F018-3888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F018-3888
  • 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 F018-3888 available by request