G394-0028 Screening compound: N-cyclohexyl-N,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound G394-0028
N-cyclohexyl-N,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-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
G394-0028
Molecular Formula
C20H29N5OS (C20 H29 N5 OS)
Compound Name
N-cyclohexyl-N,5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
IUPAC name
N-cyclohexyl-N5-dimethyl-4-(4-methylpiperazin-1-yl)thieno[23-d]pyrimidine-6-carboxamide
SMILES
Cc1c(C(N(C)C2CCCCC2)=O)sc2ncnc(N3CCN(C)CC3)c12
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.55
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.504
Distribution Coefficient, logD
3.040
Water Solubility, LogSw
-3.84
Polar Surface Area
43.217
Acid Dissociation Constant (pKa)
22.05
Base Dissociation Constant (pKb)
7.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
65.00
G394-0028 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Chemokine Receptor-Targeted Library (18382 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Receptor's ligands
- Immune system
References: we are preparing a list of scientific research reports with G394-0028 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)