V028-0908 Screening compound: 2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V028-0908 Screening compound: 2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V028-0908 Screening compound: 2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0908
2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-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

V028-0908

Molecular Formula

C23H25FN4O4S (C23 H25 FN4 O4 S)

Compound Name

2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

2-methoxyethyl 4-(4-{[(2-fluorophenyl)carbamoyl]amino}phenyl)-16-dimethyl-2-sulfanylidene-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CC(N(C)C(NC1c(cc2)ccc2NC(Nc(cccc2)c2F)=O)=S)=C1C(OCCOC)=O

InChI

InChI=1S/C23H25FN4O4S/c1-14-19(21(29)32-13-12-31-3)20(27-23(33)28(14)2)15-8-10-16(11-9-15)25-22(30)26-18-7-5-4-6-17(18)24/h4-11,20H,12-13H2,1-3H3,(H,27,33)(H2,25,26,30)

InChI Key

GILGDOZPHXTUSY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19726547

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

472.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.787

Distribution Coefficient, logD

2.787

Water Solubility, LogSw

-3.38

Polar Surface Area

75.508

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

0.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

V028-0908 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V028-0908 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0908?
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What is the minimum amount of V028-0908 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0908
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0908
  • 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 V028-0908 available by request