Z087-0148 Screening compound: N-(2-CHLOROPHENYL)-2,4-DIMETHYL-3-PROPYL-7H-PYRROLO[3',4':3,4]PYRAZOLO[1,5-A]PYRIMIDINE-8(9H)-CARBOXAMIDE

Z087-0148 Screening compound: N-(2-CHLOROPHENYL)-2,4-DIMETHYL-3-PROPYL-7H-PYRROLO[3',4':3,4]PYRAZOLO[1,5-A]PYRIMIDINE-8(9H)-CARBOXAMIDE
Z087-0148 Screening compound: N-(2-CHLOROPHENYL)-2,4-DIMETHYL-3-PROPYL-7H-PYRROLO[3',4':3,4]PYRAZOLO[1,5-A]PYRIMIDINE-8(9H)-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Z087-0148
N-(2-CHLOROPHENYL)-2,4-DIMETHYL-3-PROPYL-7H-PYRROLO[3',4':3,4]PYRAZOLO[1,5-A]PYRIMIDINE-8(9H)-CARBOXAMIDE

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

Z087-0148

Molecular Formula

C20H22ClN5O (C20 H22 ClN5 O)

Compound Name

N-(2-CHLOROPHENYL)-2,4-DIMETHYL-3-PROPYL-7H-PYRROLO[3',4':3,4]PYRAZOLO[1,5-A]PYRIMIDINE-8(9H)-CARBOXAMIDE

IUPAC name

N-(2-chlorophenyl)-911-dimethyl-10-propyl-47812-tetraazatricyclo[6.4.0.0^{26}]dodeca-16911-tetraene-4-carboxamide

SMILES

CCCc1c(C)n2nc(CN(C3)C(Nc(cccc4)c4Cl)=O)c3c2nc1C

InChI

InChI=1S/C20H22ClN5O/c1-4-7-14-12(2)22-19-15-10-25(11-18(15)24-26(19)13(14)3)20(27)23-17-9-6-5-8-16(17)21/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,23,27)

InChI Key

JBGKBAVDRKVQGS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27634511

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.924

Distribution Coefficient, logD

3.924

Water Solubility, LogSw

-4.10

Polar Surface Area

46.559

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

Z087-0148 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Z087-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z087-0148?
Check Price and Availability of Z087-0148, 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 Z087-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z087-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z087-0148
  • 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 Z087-0148 available by request