E955-1099 Screening compound: TERT-BUTYL 4-[4-[(CYCLOPROPYLAMINO)CARBONYL]-1-(4-METHOXYPHENYL)-1H-PYRAZOL-5-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

E955-1099 Screening compound: TERT-BUTYL 4-[4-[(CYCLOPROPYLAMINO)CARBONYL]-1-(4-METHOXYPHENYL)-1H-PYRAZOL-5-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE
E955-1099 Screening compound: TERT-BUTYL 4-[4-[(CYCLOPROPYLAMINO)CARBONYL]-1-(4-METHOXYPHENYL)-1H-PYRAZOL-5-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound E955-1099
TERT-BUTYL 4-[4-[(CYCLOPROPYLAMINO)CARBONYL]-1-(4-METHOXYPHENYL)-1H-PYRAZOL-5-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

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

E955-1099

Molecular Formula

C24H32N4O4 (C24 H32 N4 O4)

Compound Name

TERT-BUTYL 4-[4-[(CYCLOPROPYLAMINO)CARBONYL]-1-(4-METHOXYPHENYL)-1H-PYRAZOL-5-YL]TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE

IUPAC name

n/a

SMILES

CC(C)(C)OC(N(CC1)CCC1c(n(-c(cc1)ccc1OC)nc1)c1C(NC1CC1)=O)=O

InChI

InChI=1S/C24H32N4O4/c1-24(2,3)32-23(30)27-13-11-16(12-14-27)21-20(22(29)26-17-5-6-17)15-25-28(21)18-7-9-19(31-4)10-8-18/h7-10,15-17H,5-6,11-14H2,1-4H3,(H,26,29)

InChI Key

RINQAXPEXCUNDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14931330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.851

Distribution Coefficient, logD

4.851

Water Solubility, LogSw

-4.44

Polar Surface Area

67.157

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.20

E955-1099 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with E955-1099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E955-1099?
Check Price and Availability of E955-1099, 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 E955-1099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E955-1099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E955-1099
  • 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 E955-1099 available by request