K823-1681 Screening compound: ethyl 4-{[2,5-dimethyl-4-(morpholin-4-yl)thieno[2,3-d]pyrimidin-6-yl]formamido}-2-methylbutanoate
Chemical Structure Depiction of ChemDiv screening compound K823-1681
ethyl 4-{[2,5-dimethyl-4-(morpholin-4-yl)thieno[2,3-d]pyrimidin-6-yl]formamido}-2-methylbutanoate
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
K823-1681
Molecular Formula
C20H28N4O4S (C20 H28 N4 O4 S)
Compound Name
ethyl 4-{[2,5-dimethyl-4-(morpholin-4-yl)thieno[2,3-d]pyrimidin-6-yl]formamido}-2-methylbutanoate
IUPAC name
ethyl 4-{[25-dimethyl-4-(morpholin-4-yl)thieno[23-d]pyrimidin-6-yl]formamido}-2-methylbutanoate
SMILES
CCOC(C(C)CCNC(c1c(C)c2c(N3CCOCC3)nc(C)nc2s1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
420.53
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.848
Distribution Coefficient, logD
2.421
Water Solubility, LogSw
-3.21
Polar Surface Area
76.101
Acid Dissociation Constant (pKa)
12.96
Base Dissociation Constant (pKb)
7.62
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
60.00
K823-1681 in Drug Discovery
Included in Screening Libraries
PI3K-Targeted Library (17255 compounds)
Akt-Targeted Library (14764 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
- Kinases
References: we are preparing a list of scientific research reports with K823-1681 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)