K292-1660 Screening compound: 4-{[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-3-yl]methyl}cyclohexane-1-carboxylic acid
Chemical Structure Depiction of ChemDiv screening compound K292-1660
4-{[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-3-yl]methyl}cyclohexane-1-carboxylic acid
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
K292-1660
Molecular Formula
C19H20N4O4S3 (C19 H20 N4 O4 S3)
Compound Name
4-{[4-oxo-2-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3H,4H-thieno[3,2-d]pyrimidin-3-yl]methyl}cyclohexane-1-carboxylic acid
IUPAC name
4-{[4-oxo-2-({[(13-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-3H4H-thieno[32-d]pyrimidin-3-yl]methyl}cyclohexane-1-carboxylic acid
SMILES
OC(C1CCC(CN(C2=O)C(SCC(Nc3nccs3)=O)=Nc3c2scc3)CC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
464.59
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.795
Distribution Coefficient, logD
0.234
Water Solubility, LogSw
-3.23
Polar Surface Area
89.017
Acid Dissociation Constant (pKa)
4.84
Base Dissociation Constant (pKb)
0.37
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.10
K292-1660 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with K292-1660 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)