3389-1984 Screening compound: 4,6,7-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline

3389-1984 Screening compound: 4,6,7-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline
3389-1984 Screening compound: 4,6,7-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 3389-1984
4,6,7-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline

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

3389-1984

Molecular Formula

C18H17N3O2S (C18 H17 N3 O2 S)

Compound Name

4,6,7-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline

IUPAC name

467-trimethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}quinazoline

SMILES

Cc(cc1c(C)n2)c(C)cc1nc2SCc(cc1)ccc1[N+]([O-])=O

InChI

InChI=1S/C18H17N3O2S/c1-11-8-16-13(3)19-18(20-17(16)9-12(11)2)24-10-14-4-6-15(7-5-14)21(22)23/h4-9H,10H2,1-3H3

InChI Key

LTDIXYZHOBMHDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.139

Distribution Coefficient, logD

5.139

Water Solubility, LogSw

-5.22

Polar Surface Area

50.933

Acid Dissociation Constant (pKa)

21.64

Base Dissociation Constant (pKb)

1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 3389-1984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3389-1984?
Check Price and Availability of 3389-1984, 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 3389-1984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3389-1984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3389-1984
  • 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 3389-1984 available by request