8019-2497 Screening compound: 4-{1-[3-(2,6-dimethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}-1-(prop-2-en-1-yl)pyrrolidin-2-one
Chemical Structure Depiction of ChemDiv screening compound 8019-2497
4-{1-[3-(2,6-dimethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}-1-(prop-2-en-1-yl)pyrrolidin-2-one
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
8019-2497
Molecular Formula
C25H29N3O2 (C25 H29 N3 O2)
Compound Name
4-{1-[3-(2,6-dimethylphenoxy)propyl]-1H-1,3-benzodiazol-2-yl}-1-(prop-2-en-1-yl)pyrrolidin-2-one
IUPAC name
4-{1-[3-(26-dimethylphenoxy)propyl]-1H-13-benzodiazol-2-yl}-1-(prop-2-en-1-yl)pyrrolidin-2-one
SMILES
Cc1cccc(C)c1OCCCn1c(cccc2)c2nc1C(C1)CN(CC=C)C1=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
403.52
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.736
Distribution Coefficient, logD
4.736
Water Solubility, LogSw
-4.56
Polar Surface Area
34.911
Acid Dissociation Constant (pKa)
13.27
Base Dissociation Constant (pKb)
3.54
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
36.00
References: we are preparing a list of scientific research reports with 8019-2497 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)