4737-7515 Screening compound: 3,5-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

4737-7515 Screening compound: 3,5-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
4737-7515 Screening compound: 3,5-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4737-7515
3,5-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-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

4737-7515

Molecular Formula

C22H17F3N2O6 (C22 H17 F3 N2 O6)

Compound Name

3,5-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

IUPAC name

35-dimethyl 4-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-14-dihydropyridine-35-dicarboxylate

SMILES

COC(C(C(c(cc1)ccc1[N+]([O-])=O)C(C(OC)=O)=C1)=CN1c1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C22H17F3N2O6/c1-32-20(28)17-11-26(16-5-3-4-14(10-16)22(23,24)25)12-18(21(29)33-2)19(17)13-6-8-15(9-7-13)27(30)31/h3-12,19H,1-2H3

InChI Key

OMUDAYHUNWJCLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03145571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.271

Distribution Coefficient, logD

4.271

Water Solubility, LogSw

-4.65

Polar Surface Area

78.378

Acid Dissociation Constant (pKa)

30.04

Base Dissociation Constant (pKb)

-0.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 4737-7515 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4737-7515?
Check Price and Availability of 4737-7515, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4737-7515 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4737-7515
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4737-7515
  • 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 4737-7515 available by request