E955-1270 Screening compound: tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate

E955-1270 Screening compound: tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate
E955-1270 Screening compound: tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E955-1270
tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate

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

E955-1270

Molecular Formula

C29H43N7O5 (C29 H43 N7 O5)

Compound Name

tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate

IUPAC name

tert-butyl 4-(4-{[3-(4-ethylpiperazin-1-yl)propyl]carbamoyl}-1-(4-nitrophenyl)-1H-pyrazol-5-yl)piperidine-1-carboxylate

SMILES

CCN1CCN(CCCNC(c2c(C(CC3)CCN3C(OC(C)(C)C)=O)n(-c(cc3)ccc3[N+]([O-])=O)nc2)=O)CC1

InChI

InChI=1S/C29H43N7O5/c1-5-32-17-19-33(20-18-32)14-6-13-30-27(37)25-21-31-35(23-7-9-24(10-8-23)36(39)40)26(25)22-11-15-34(16-12-22)28(38)41-29(2,3)4/h7-10,21-22H,5-6,11-20H2,1-4H3,(H,30,37)

InChI Key

PVGJFNSKVFMORX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14931401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

569.7

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

4.292

Distribution Coefficient, logD

3.344

Water Solubility, LogSw

-3.94

Polar Surface Area

100.299

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.10

E955-1270 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with E955-1270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E955-1270?
Check Price and Availability of E955-1270, 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 E955-1270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E955-1270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E955-1270
  • 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 E955-1270 available by request