G887-0716 Screening compound: (4-ethylpiperazino)[1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-3-piperidyl]methanone
Chemical Structure Depiction of ChemDiv screening compound G887-0716
(4-ethylpiperazino)[1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-3-piperidyl]methanone
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
G887-0716
Molecular Formula
C20H29N5OS (C20 H29 N5 OS)
Compound Name
(4-ethylpiperazino)[1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-3-piperidyl]methanone
IUPAC name
1-ethyl-4-(1-{6-ethylthieno[23-d]pyrimidin-4-yl}piperidine-3-carbonyl)piperazine
SMILES
CCc1cc2c(N(CCC3)CC3C(N3CCN(CC)CC3)=O)ncnc2s1
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
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.867
Distribution Coefficient, logD
2.427
Water Solubility, LogSw
-2.89
Polar Surface Area
44.657
Acid Dissociation Constant (pKa)
21.74
Base Dissociation Constant (pKb)
7.64
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
65.00
G887-0716 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with G887-0716 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)