K284-3569 Screening compound: 3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

K284-3569 Screening compound: 3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
K284-3569 Screening compound: 3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-3569
3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-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

K284-3569

Molecular Formula

C22H23ClN4O2S (C22 H23 ClN4 O2 S)

Compound Name

3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide

IUPAC name

3-[(4-chlorophenyl)methyl]-4-oxo-N-[2-(pyrrolidin-1-yl)ethyl]-2-sulfanylidene-1234-tetrahydroquinazoline-7-carboxamide

SMILES

O=C(c(cc1)cc(NC(N2Cc(cc3)ccc3Cl)=S)c1C2=O)NCCN1CCCC1

InChI

InChI=1S/C22H23ClN4O2S/c23-17-6-3-15(4-7-17)14-27-21(29)18-8-5-16(13-19(18)25-22(27)30)20(28)24-9-12-26-10-1-2-11-26/h3-8,13H,1-2,9-12,14H2,(H,24,28)(H,25,30)

InChI Key

MDSLEOQUCYMIHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08541183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.486

Distribution Coefficient, logD

2.077

Water Solubility, LogSw

-4.11

Polar Surface Area

55.921

Acid Dissociation Constant (pKa)

10.11

Base Dissociation Constant (pKb)

8.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

K284-3569 in Drug Discovery

Included in Screening Libraries

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

Human Ion Channels Annotated Library (353 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with K284-3569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-3569?
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What is the minimum amount of K284-3569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-3569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-3569
  • 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 K284-3569 available by request