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
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 Key
MDL Number (MFCD)
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
- Antiviral
- Infections
- Immune system
- 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
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)