P930-2906 Screening compound: 1-[(2S)-2-(5-ISOPROPYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-2-(3-THIENYL)-1-ETHANONE
Chemical Structure Depiction of ChemDiv screening compound P930-2906
1-[(2S)-2-(5-ISOPROPYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-2-(3-THIENYL)-1-ETHANONE
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
P930-2906
Molecular Formula
C15H20N4OS (C15 H20 N4 OS)
Compound Name
1-[(2S)-2-(5-ISOPROPYL-4H-1,2,4-TRIAZOL-3-YL)TETRAHYDRO-1H-PYRROL-1-YL]-2-(3-THIENYL)-1-ETHANONE
IUPAC name
n/a
SMILES
CC(C)c1nnc([C@H](CCC2)N2C(Cc2cscc2)=O)[nH]1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
304.42
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
1.636
Distribution Coefficient, logD
1.634
Water Solubility, LogSw
-2.26
Polar Surface Area
51.223
Acid Dissociation Constant (pKa)
7.70
Base Dissociation Constant (pKb)
3.24
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
53.30
P930-2906 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
References: we are preparing a list of scientific research reports with P930-2906 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)