K891-0240 Screening compound: 3-amino-4-(2-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound K891-0240
3-amino-4-(2-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-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
K891-0240
Molecular Formula
C18H16ClN3OS (C18 H16 ClN3 OS)
Compound Name
3-amino-4-(2-chlorophenyl)-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide
IUPAC name
3-amino-4-(2-chlorophenyl)-5H6H7H8H-thieno[23-b]quinoline-2-carboxamide
SMILES
NC(c(sc1c2c(-c(cccc3)c3Cl)c(CCCC3)c3n1)c2N)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
357.86
Hydrogen Bond Acceptors Count
3.00
Hydrogen Bond Donors Count
4.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
4.092
Distribution Coefficient, logD
4.069
Water Solubility, LogSw
-4.71
Polar Surface Area
64.554
Acid Dissociation Constant (pKa)
15.25
Base Dissociation Constant (pKb)
6.13
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.20
K891-0240 in Drug Discovery
Included in Screening Libraries
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 K891-0240 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)