K284-2682 Screening compound: 3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

K284-2682 Screening compound: 3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
K284-2682 Screening compound: 3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-2682
3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

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

K284-2682

Molecular Formula

C18H24N4O2S (C18 H24 N4 O2 S)

Compound Name

3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

IUPAC name

3-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxamide

SMILES

CN(C)CCNC(c(cc1)cc(NC(N2C3CCCC3)=S)c1C2=O)=O

InChI

InChI=1S/C18H24N4O2S/c1-21(2)10-9-19-16(23)12-7-8-14-15(11-12)20-18(25)22(17(14)24)13-5-3-4-6-13/h7-8,11,13H,3-6,9-10H2,1-2H3,(H,19,23)(H,20,25)

InChI Key

MEHIAIAKRYLHIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05023799

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.869

Distribution Coefficient, logD

1.030

Water Solubility, LogSw

-2.73

Polar Surface Area

55.298

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

8.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

K284-2682 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anticancer Library (62698 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cardiovascular

References: we are preparing a list of scientific research reports with K284-2682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-2682?
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What is the minimum amount of K284-2682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-2682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-2682
  • 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 K284-2682 available by request