K272-1324 Screening compound: 4-chloro-N~13~-(2,4-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-13-carboxamide

K272-1324 Screening compound: 4-chloro-N~13~-(2,4-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-13-carboxamide
K272-1324 Screening compound: 4-chloro-N~13~-(2,4-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-13-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K272-1324
4-chloro-N~13~-(2,4-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-13-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

K272-1324

Molecular Formula

C24H28ClN3O3S (C24 H28 ClN3 O3 S)

Compound Name

4-chloro-N~13~-(2,4-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-thioxo-8-oxa-10,12-diazatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene-13-carboxamide

IUPAC name

4-chloro-N-(24-dimethylphenyl)-10-(3-methoxypropyl)-9-methyl-11-sulfanylidene-8-oxa-1012-diazatricyclo[7.3.1.0^{27}]trideca-246-triene-13-carboxamide

SMILES

CC(C(C1N2)C(Nc3c(C)cc(C)cc3)=O)(N(CCCOC)C2=S)Oc(cc2)c1cc2Cl

InChI

InChI=1S/C24H28ClN3O3S/c1-14-6-8-18(15(2)12-14)26-22(29)20-21-17-13-16(25)7-9-19(17)31-24(20,3)28(23(32)27-21)10-5-11-30-4/h6-9,12-13,20-21H,5,10-11H2,1-4H3,(H,26,29)(H,27,32)

InChI Key

DVKRSKGNYXXFGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15086053

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.088

Distribution Coefficient, logD

5.088

Water Solubility, LogSw

-5.23

Polar Surface Area

52.109

Acid Dissociation Constant (pKa)

10.64

Base Dissociation Constant (pKb)

1.73

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with K272-1324 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K272-1324?
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What is the minimum amount of K272-1324 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K272-1324
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K272-1324
  • 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 K272-1324 available by request