P315-0792 Screening compound: 3-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]-1-[3-(methylsulfanyl)phenyl]urea
Chemical Structure Depiction of ChemDiv screening compound P315-0792
3-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]-1-[3-(methylsulfanyl)phenyl]urea
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
P315-0792
Molecular Formula
C20H23N3O2S (C20 H23 N3 O2 S)
Compound Name
3-[1-(3,5-dimethylphenyl)-2-oxopyrrolidin-3-yl]-1-[3-(methylsulfanyl)phenyl]urea
IUPAC name
3-[1-(35-dimethylphenyl)-2-oxopyrrolidin-3-yl]-1-[3-(methylsulfanyl)phenyl]urea
SMILES
Cc1cc(N(CCC2NC(Nc3cccc(SC)c3)=O)C2=O)cc(C)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
369.49
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.894
Distribution Coefficient, logD
3.894
Water Solubility, LogSw
-3.90
Polar Surface Area
50.325
Acid Dissociation Constant (pKa)
11.52
Base Dissociation Constant (pKb)
1.13
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
30.00
P315-0792 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
References: we are preparing a list of scientific research reports with P315-0792 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)