K284-1825 Screening compound: 3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

K284-1825 Screening compound: 3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
K284-1825 Screening compound: 3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-1825
3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-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

K284-1825

Molecular Formula

C17H15N3O3S (C17 H15 N3 O3 S)

Compound Name

3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

IUPAC name

3-[(furan-2-yl)methyl]-4-oxo-N-(prop-2-en-1-yl)-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxamide

SMILES

C=CCNC(c(cc1)cc(NC(N2Cc3ccco3)=S)c1C2=O)=O

InChI

InChI=1S/C17H15N3O3S/c1-2-7-18-15(21)11-5-6-13-14(9-11)19-17(24)20(16(13)22)10-12-4-3-8-23-12/h2-6,8-9H,1,7,10H2,(H,18,21)(H,19,24)

InChI Key

FAMQBSXFESACMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05024168

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.39

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

2.159

Distribution Coefficient, logD

2.158

Water Solubility, LogSw

-3.13

Polar Surface Area

59.593

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

-2.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

K284-1825 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K284-1825 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-1825?
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What is the minimum amount of K284-1825 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-1825
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-1825
  • 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 K284-1825 available by request