Z218-2197 Screening compound: 2-bromo-N-[3-(1-ethyl-3-methyl-1H-indol-2-yl)-1H-pyrazol-5-yl]benzamide
Chemical Structure Depiction of ChemDiv screening compound Z218-2197
2-bromo-N-[3-(1-ethyl-3-methyl-1H-indol-2-yl)-1H-pyrazol-5-yl]benzamide
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
Z218-2197
Molecular Formula
C21H19BrN4O (C21 H19 BrN4 O)
Compound Name
2-bromo-N-[3-(1-ethyl-3-methyl-1H-indol-2-yl)-1H-pyrazol-5-yl]benzamide
IUPAC name
2-bromo-N-[3-(1-ethyl-3-methyl-1H-indol-2-yl)-1H-pyrazol-5-yl]benzamide
SMILES
CCn1c(-c2n[nH]c(NC(c(cccc3)c3Br)=O)c2)c(C)c2c1cccc2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
423.31
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.706
Distribution Coefficient, logD
4.706
Water Solubility, LogSw
-4.49
Polar Surface Area
46.613
Acid Dissociation Constant (pKa)
11.78
Base Dissociation Constant (pKb)
-0.83
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
14.30
Z218-2197 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
C-Met Library (15277 compounds)
Indole Derivatives (10091 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Kinases
- Receptor's ligands
- Cyclic compounds
References: we are preparing a list of scientific research reports with Z218-2197 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)