3888-0255 Screening compound: 5-benzyl-2-(4-chlorophenyl)-3-(4-fluorophenyl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Chemical Structure Depiction of ChemDiv screening compound 3888-0255
5-benzyl-2-(4-chlorophenyl)-3-(4-fluorophenyl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-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
3888-0255
Molecular Formula
C24H18ClFN2O3 (C24 H18 ClFN2 O3)
Compound Name
5-benzyl-2-(4-chlorophenyl)-3-(4-fluorophenyl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
IUPAC name
5-benzyl-2-(4-chlorophenyl)-3-(4-fluorophenyl)-hexahydro-2H-pyrrolo[34-d][12]oxazole-46-dione
SMILES
O=C(C1C(c(cc2)ccc2F)N(c(cc2)ccc2Cl)OC11)N(Cc2ccccc2)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
436.87
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
4.406
Distribution Coefficient, logD
4.406
Water Solubility, LogSw
-5.07
Polar Surface Area
44.245
Acid Dissociation Constant (pKa)
13.83
Base Dissociation Constant (pKb)
-2.93
Number of Chiral Centers
3.00
Percent sp3 carbon bonding
16.70
3888-0255 in Drug Discovery
Included in Screening Libraries
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Cancer
- PPI modulators
References: we are preparing a list of scientific research reports with 3888-0255 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of 3888-0255, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)