Y508-0931 Screening compound: (1R,9aR)octahydro-2H-quinolizin-1-ylmethyl 3-bromobenzoate
Chemical Structure Depiction of ChemDiv screening compound Y508-0931
(1R,9aR)octahydro-2H-quinolizin-1-ylmethyl 3-bromobenzoate
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
Y508-0931
Molecular Formula
C17H22BrNO2 (C17 H22 BrNO2)
Compound Name
(1R,9aR)octahydro-2H-quinolizin-1-ylmethyl 3-bromobenzoate
IUPAC name
n/a
SMILES
O=C(c1cccc(Br)c1)OC[C@H]1[C@@H](CCCC2)N2CCC1
InChI Key
Chemical and Physical Properties
Saltdata
HCl
Molecular Weight
352.27
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
3.801
Distribution Coefficient, logD
0.788
Water Solubility, LogSw
-3.92
Polar Surface Area
24.446
Acid Dissociation Constant (pKa)
25.60
Base Dissociation Constant (pKb)
10.41
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
58.80
References: we are preparing a list of scientific research reports with Y508-0931 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)