K284-7547 Screening compound: 3-[3-(azepan-1-yl)-3-oxopropyl]-6,7-diethoxy-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

K284-7547 Screening compound: 3-[3-(azepan-1-yl)-3-oxopropyl]-6,7-diethoxy-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one
K284-7547 Screening compound: 3-[3-(azepan-1-yl)-3-oxopropyl]-6,7-diethoxy-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-7547
3-[3-(azepan-1-yl)-3-oxopropyl]-6,7-diethoxy-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

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

K284-7547

Molecular Formula

C21H29N3O4S (C21 H29 N3 O4 S)

Compound Name

3-[3-(azepan-1-yl)-3-oxopropyl]-6,7-diethoxy-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

3-[3-(azepan-1-yl)-3-oxopropyl]-67-diethoxy-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

CCOc(c(OCC)c1)cc(C(N2CCC(N3CCCCCC3)=O)=O)c1NC2=S

InChI

InChI=1S/C21H29N3O4S/c1-3-27-17-13-15-16(14-18(17)28-4-2)22-21(29)24(20(15)26)12-9-19(25)23-10-7-5-6-8-11-23/h13-14H,3-12H2,1-2H3,(H,22,29)

InChI Key

CWDWOLZGLOXBMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15089750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.415

Distribution Coefficient, logD

2.389

Water Solubility, LogSw

-3.07

Polar Surface Area

58.440

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

5.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with K284-7547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-7547?
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What is the minimum amount of K284-7547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-7547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-7547
  • 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 K284-7547 available by request