V020-1837 Screening compound: 6,7,8-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-3,4-dihydroquinazolin-4-one

V020-1837 Screening compound: 6,7,8-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-3,4-dihydroquinazolin-4-one
V020-1837 Screening compound: 6,7,8-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1837
6,7,8-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-3,4-dihydroquinazolin-4-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

V020-1837

Molecular Formula

C25H23N3O6S (C25 H23 N3 O6 S)

Compound Name

6,7,8-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

678-trimethoxy-2-{[(4-methylphenyl)methyl]sulfanyl}-3-(4-nitrophenyl)-34-dihydroquinazolin-4-one

SMILES

Cc1ccc(CSC(N(c(cc2)ccc2[N+]([O-])=O)C(c2cc(OC)c3OC)=O)=Nc2c3OC)cc1

InChI

InChI=1S/C25H23N3O6S/c1-15-5-7-16(8-6-15)14-35-25-26-21-19(13-20(32-2)22(33-3)23(21)34-4)24(29)27(25)17-9-11-18(12-10-17)28(30)31/h5-13H,14H2,1-4H3

InChI Key

ICHMEDPDZMAINN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19858249

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.728

Distribution Coefficient, logD

4.728

Water Solubility, LogSw

-4.70

Polar Surface Area

79.354

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with V020-1837 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1837?
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What is the minimum amount of V020-1837 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1837
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1837
  • 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 V020-1837 available by request