V011-6578 Screening compound: propan-2-yl 2-{[ethyl(2-hydroxypropyl)amino]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of ChemDiv screening compound V011-6578
propan-2-yl 2-{[ethyl(2-hydroxypropyl)amino]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
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
V011-6578
Molecular Formula
C17H25N3O4S (C17 H25 N3 O4 S)
Compound Name
propan-2-yl 2-{[ethyl(2-hydroxypropyl)amino]methyl}-5-methyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
IUPAC name
propan-2-yl 2-{[ethyl(2-hydroxypropyl)amino]methyl}-5-methyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxylate
SMILES
CCN(CC(C)O)CC(N1)=Nc(sc(C(OC(C)C)=O)c2C)c2C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
367.47
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.637
Distribution Coefficient, logD
1.635
Water Solubility, LogSw
-2.33
Polar Surface Area
75.693
Acid Dissociation Constant (pKa)
10.45
Base Dissociation Constant (pKb)
5.15
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
58.80
V011-6578 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
Antiviral Library (67538 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Antiviral
- Infections
- Immune system
- Agro
References: we are preparing a list of scientific research reports with V011-6578 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)