M814-0012 Screening compound: 2-methoxy-5-(pyrrolidine-1-carbonyl)pyrimidine
Chemical Structure Depiction of ChemDiv screening compound M814-0012
2-methoxy-5-(pyrrolidine-1-carbonyl)pyrimidine
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
M814-0012
Molecular Formula
C10H13N3O2 (C10 H13 N3 O2)
Compound Name
2-methoxy-5-(pyrrolidine-1-carbonyl)pyrimidine
IUPAC name
2-methoxy-5-(pyrrolidine-1-carbonyl)pyrimidine
SMILES
COc(nc1)ncc1C(N1CCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
207.23
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
0.524
Distribution Coefficient, logD
0.524
Water Solubility, LogSw
-0.92
Polar Surface Area
44.212
Acid Dissociation Constant (pKa)
25.89
Base Dissociation Constant (pKb)
-1.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
M814-0012 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
SmartTM Library (51161 compounds)
Soluble Diversity Library (15920 compounds)
Included in 1.7M Stock Database
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with M814-0012 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)