C204-0371 Screening compound: N'-(3,4-dimethoxyphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
Chemical Structure Depiction of ChemDiv screening compound C204-0371
N'-(3,4-dimethoxyphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
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
C204-0371
Molecular Formula
C28H35N5O4 (C28 H35 N5 O4)
Compound Name
N'-(3,4-dimethoxyphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
IUPAC name
N'-(34-dimethoxyphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide
SMILES
CCN(CC1)CCN1c1cc(C)c(cc(cc2)NC(CCC(Nc(cc3)cc(OC)c3OC)=O)=O)c2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
505.62
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.485
Distribution Coefficient, logD
2.797
Water Solubility, LogSw
-3.63
Polar Surface Area
76.310
Acid Dissociation Constant (pKa)
11.10
Base Dissociation Constant (pKb)
7.99
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
39.30
C204-0371 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Dark Chemical Matter Library (18430 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Epigenetics Focused Set (26518 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Epigenetic
References: we are preparing a list of scientific research reports with C204-0371 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)