V022-7964 Screening compound: 4-(2,3-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine

V022-7964 Screening compound: 4-(2,3-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
V022-7964 Screening compound: 4-(2,3-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-7964
4-(2,3-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine

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

V022-7964

Molecular Formula

C20H19N3O3S (C20 H19 N3 O3 S)

Compound Name

4-(2,3-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine

IUPAC name

4-(23-dimethylphenoxy)-6-methyl-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine

SMILES

Cc1cccc(Oc2cc(C)nc(SCc3cc([N+]([O-])=O)ccc3)n2)c1C

InChI

InChI=1S/C20H19N3O3S/c1-13-6-4-9-18(15(13)3)26-19-10-14(2)21-20(22-19)27-12-16-7-5-8-17(11-16)23(24)25/h4-11H,12H2,1-3H3

InChI Key

LKPNUDLETPSFJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19889914

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

381.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.577

Distribution Coefficient, logD

5.577

Water Solubility, LogSw

-5.58

Polar Surface Area

57.183

Acid Dissociation Constant (pKa)

22.01

Base Dissociation Constant (pKb)

1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with V022-7964 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-7964?
Check Price and Availability of V022-7964, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V022-7964 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-7964
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-7964
  • 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 V022-7964 available by request