3374-0595 Screening compound: 3-butyl-10-(2,3-dimethylphenyl)-2H,3H,4H,10H-pyrimido[4,5-b]quinoline-2,4-dione
Chemical Structure Depiction of ChemDiv screening compound 3374-0595
3-butyl-10-(2,3-dimethylphenyl)-2H,3H,4H,10H-pyrimido[4,5-b]quinoline-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
3374-0595
Molecular Formula
C23H23N3O2 (C23 H23 N3 O2)
Compound Name
3-butyl-10-(2,3-dimethylphenyl)-2H,3H,4H,10H-pyrimido[4,5-b]quinoline-2,4-dione
IUPAC name
3-butyl-10-(23-dimethylphenyl)-2H3H4H10H-pyrimido[45-b]quinoline-24-dione
SMILES
CCCCN(C(C1=Cc(cccc2)c2N(c2c(C)c(C)ccc2)C1=N1)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
373.45
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.699
Distribution Coefficient, logD
4.699
Water Solubility, LogSw
-4.19
Polar Surface Area
39.070
Acid Dissociation Constant (pKa)
28.32
Base Dissociation Constant (pKb)
1.98
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.10
3374-0595 in Drug Discovery
Included in Screening Libraries
Antiparasite Library (23996 compounds)
Nucleic Acid Ligands (8311 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
- Agro
References: we are preparing a list of scientific research reports with 3374-0595 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)