K895-0268 Screening compound: N-benzyl-N,5-dimethyl-4-(methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound K895-0268
N-benzyl-N,5-dimethyl-4-(methylanilino)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
K895-0268
Molecular Formula
C23H22N4OS (C23 H22 N4 OS)
Compound Name
N-benzyl-N,5-dimethyl-4-(methylanilino)thieno[2,3-d]pyrimidine-6-carboxamide
IUPAC name
N-benzyl-N5-dimethyl-4-[methyl(phenyl)amino]thieno[23-d]pyrimidine-6-carboxamide
SMILES
Cc1c(C(N(C)Cc2ccccc2)=O)sc2ncnc(N(C)c3ccccc3)c12
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
402.52
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.714
Distribution Coefficient, logD
4.683
Water Solubility, LogSw
-4.70
Polar Surface Area
39.410
Acid Dissociation Constant (pKa)
24.15
Base Dissociation Constant (pKb)
6.26
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
17.39
K895-0268 in Drug Discovery
Included in Screening Libraries
Angiogenesis library (14822 compounds)
Immunological Library (6760 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Cancer
- Immune system
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- Others
References: we are preparing a list of scientific research reports with K895-0268 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)