E920-0184 Screening compound: N-[3-(4-methylpiperazin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound E920-0184
N-[3-(4-methylpiperazin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[d][1,2]oxazole-3-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
E920-0184
Molecular Formula
C17H28N4O2 (C17 H28 N4 O2)
Compound Name
N-[3-(4-methylpiperazin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[d][1,2]oxazole-3-carboxamide
IUPAC name
N-[3-(4-methylpiperazin-1-yl)propyl]-4H5H6H7H8H-cyclohepta[d][12]oxazole-3-carboxamide
SMILES
CN1CCN(CCCNC(c2noc3c2CCCCC3)=O)CC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
320.44
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
1.032
Distribution Coefficient, logD
-0.118
Water Solubility, LogSw
-1.06
Polar Surface Area
54.683
Acid Dissociation Constant (pKa)
14.63
Base Dissociation Constant (pKb)
8.52
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
76.50
E920-0184 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Protein Kinases Inhibitors Library (36801 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Kinases
- PPI modulators
References: we are preparing a list of scientific research reports with E920-0184 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)