K284-3658 Screening compound: methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

K284-3658 Screening compound: methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
K284-3658 Screening compound: methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-3658
methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)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

K284-3658

Molecular Formula

C27H32N4O4S (C27 H32 N4 O4 S)

Compound Name

methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate

IUPAC name

methyl 3-[(4-{[3-(4-methylpiperidin-1-yl)propyl]carbamoyl}phenyl)methyl]-4-oxo-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxylate

SMILES

CC1CCN(CCCNC(c2ccc(CN(C(c(ccc(C(OC)=O)c3)c3N3)=O)C3=S)cc2)=O)CC1

InChI

InChI=1S/C27H32N4O4S/c1-18-10-14-30(15-11-18)13-3-12-28-24(32)20-6-4-19(5-7-20)17-31-25(33)22-9-8-21(26(34)35-2)16-23(22)29-27(31)36/h4-9,16,18H,3,10-15,17H2,1-2H3,(H,28,32)(H,29,36)

InChI Key

FLNZARIXUZFDBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15087901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.739

Distribution Coefficient, logD

1.279

Water Solubility, LogSw

-3.92

Polar Surface Area

76.729

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

9.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

K284-3658 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with K284-3658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-3658?
Check Price and Availability of K284-3658, 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 K284-3658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-3658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-3658
  • 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 K284-3658 available by request