L329-0189 Screening compound: 1,3-dimethyl-6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Chemical Structure Depiction of ChemDiv screening compound L329-0189
1,3-dimethyl-6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
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
L329-0189
Molecular Formula
C16H19N5O3 (C16 H19 N5 O3)
Compound Name
1,3-dimethyl-6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC name
13-dimethyl-6-[4-(pyridine-3-carbonyl)piperazin-1-yl]-1234-tetrahydropyrimidine-24-dione
SMILES
CN(C(C=C(N1C)N(CC2)CCN2C(c2cnccc2)=O)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
329.36
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
-0.358
Distribution Coefficient, logD
-0.358
Water Solubility, LogSw
-0.26
Polar Surface Area
61.698
Acid Dissociation Constant (pKa)
28.59
Base Dissociation Constant (pKb)
3.49
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
37.50
L329-0189 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS MPO Library (28609 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Nervous system
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with L329-0189 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)