K232-1812 Screening compound: N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-N'-cycloheptylbutanediamide

K232-1812 Screening compound: N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-N'-cycloheptylbutanediamide
K232-1812 Screening compound: N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-N'-cycloheptylbutanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K232-1812
N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-N'-cycloheptylbutanediamide

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

K232-1812

Molecular Formula

C23H24ClN3O4S (C23 H24 ClN3 O4 S)

Compound Name

N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-N'-cycloheptylbutanediamide

IUPAC name

N-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-13-thiazol-2-yl]-N'-cycloheptylbutanediamide

SMILES

O=C(CCC(Nc1nc(C2=Cc(cc(cc3)Cl)c3OC2=O)cs1)=O)NC1CCCCCC1

InChI

InChI=1S/C23H24ClN3O4S/c24-15-7-8-19-14(11-15)12-17(22(30)31-19)18-13-32-23(26-18)27-21(29)10-9-20(28)25-16-5-3-1-2-4-6-16/h7-8,11-13,16H,1-6,9-10H2,(H,25,28)(H,26,27,29)

InChI Key

MDGMULJPBXWZOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03722968

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.425

Distribution Coefficient, logD

4.414

Water Solubility, LogSw

-4.67

Polar Surface Area

78.341

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

2.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

K232-1812 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K232-1812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K232-1812?
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What is the minimum amount of K232-1812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K232-1812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K232-1812
  • 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 K232-1812 available by request