K837-0934 Screening compound: 3,5-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

K837-0934 Screening compound: 3,5-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate
K837-0934 Screening compound: 3,5-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K837-0934
3,5-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

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

K837-0934

Molecular Formula

C22H20FNO5 (C22 H20 FNO5)

Compound Name

3,5-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-dimethyl 1-[(4-fluorophenyl)methyl]-4-(3-hydroxyphenyl)-14-dihydropyridine-35-dicarboxylate

SMILES

COC(C(C1c2cc(O)ccc2)=CN(Cc(cc2)ccc2F)C=C1C(OC)=O)=O

InChI

InChI=1S/C22H20FNO5/c1-28-21(26)18-12-24(11-14-6-8-16(23)9-7-14)13-19(22(27)29-2)20(18)15-4-3-5-17(25)10-15/h3-10,12-13,20,25H,11H2,1-2H3

InChI Key

ODPYUMPNAOUAEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04056999

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.129

Distribution Coefficient, logD

3.107

Water Solubility, LogSw

-2.85

Polar Surface Area

62.894

Acid Dissociation Constant (pKa)

8.68

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

K837-0934 in Drug Discovery

Included in Screening Libraries

Hsp90-Targeted Library (11355 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with K837-0934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K837-0934?
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What is the minimum amount of K837-0934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K837-0934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K837-0934
  • 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 K837-0934 available by request