K287-0278 Screening compound: methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

K287-0278 Screening compound: methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
K287-0278 Screening compound: methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K287-0278
methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-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

K287-0278

Molecular Formula

C18H16N2O3S (C18 H16 N2 O3 S)

Compound Name

methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

IUPAC name

methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxylate

SMILES

Cc1ccc(CN(C(c(ccc(C(OC)=O)c2)c2N2)=O)C2=S)cc1

InChI

InChI=1S/C18H16N2O3S/c1-11-3-5-12(6-4-11)10-20-16(21)14-8-7-13(17(22)23-2)9-15(14)19-18(20)24/h3-9H,10H2,1-2H3,(H,19,24)

InChI Key

NHHDCBKWXKVPOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024782

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.973

Distribution Coefficient, logD

3.972

Water Solubility, LogSw

-4.13

Polar Surface Area

48.492

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

-10.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

K287-0278 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 K287-0278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K287-0278?
Check Price and Availability of K287-0278, 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 K287-0278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K287-0278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K287-0278
  • 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 K287-0278 available by request