Y070-0313 Screening compound: 3,5-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Y070-0313 Screening compound: 3,5-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Y070-0313 Screening compound: 3,5-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0313
3,5-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-2,6-dimethyl-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

Y070-0313

Molecular Formula

C27H32ClNO5 (C27 H32 ClNO5)

Compound Name

3,5-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-bis(2-methylpropyl) 4-[5-(3-chlorophenyl)furan-2-yl]-26-dimethyl-14-dihydropyridine-35-dicarboxylate

SMILES

CC(C)COC(C(C1c2ccc(-c3cccc(Cl)c3)o2)=C(C)NC(C)=C1C(OCC(C)C)=O)=O

InChI

InChI=1S/C27H32ClNO5/c1-15(2)13-32-26(30)23-17(5)29-18(6)24(27(31)33-14-16(3)4)25(23)22-11-10-21(34-22)19-8-7-9-20(28)12-19/h7-12,15-16,25,29H,13-14H2,1-6H3

InChI Key

SMUVWJAVTALUJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03464436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.01

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.817

Distribution Coefficient, logD

2.536

Water Solubility, LogSw

-6.41

Polar Surface Area

61.012

Acid Dissociation Constant (pKa)

3.12

Base Dissociation Constant (pKb)

-1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

References: we are preparing a list of scientific research reports with Y070-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0313?
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What is the minimum amount of Y070-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0313
  • 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 Y070-0313 available by request