K850-0255 Screening compound: 3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-N-(4-phenoxyphenyl)-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of ChemDiv screening compound K850-0255
3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-N-(4-phenoxyphenyl)-3H,4H-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
K850-0255
Molecular Formula
C29H24N4O5S (C29 H24 N4 O5 S)
Compound Name
3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-N-(4-phenoxyphenyl)-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide
IUPAC name
3-{[(2-methoxyphenyl)carbamoyl]methyl}-5-methyl-4-oxo-N-(4-phenoxyphenyl)-3H4H-thieno[23-d]pyrimidine-6-carboxamide
SMILES
Cc1c(C(Nc(cc2)ccc2Oc2ccccc2)=O)sc(N=CN2CC(Nc(cccc3)c3OC)=O)c1C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
540.6
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
4.646
Distribution Coefficient, logD
4.645
Water Solubility, LogSw
-4.59
Polar Surface Area
86.162
Acid Dissociation Constant (pKa)
9.96
Base Dissociation Constant (pKb)
0.38
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
10.30
K850-0255 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Immunological Library (6760 compounds)
PD-1/L1 Library (498 compounds)
Included in 1.7M Stock Database
- Cancer
- Immune system
- Cancer
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Immune system
- Others
References: we are preparing a list of scientific research reports with K850-0255 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)