F064-0051 Screening compound: ethyl 3-[3-(2-methoxy-2-oxoethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido]benzoate
Chemical Structure Depiction of ChemDiv screening compound F064-0051
ethyl 3-[3-(2-methoxy-2-oxoethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido]benzoate
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
F064-0051
Molecular Formula
C19H18N2O8S (C19 H18 N2 O8 S)
Compound Name
ethyl 3-[3-(2-methoxy-2-oxoethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamido]benzoate
IUPAC name
ethyl 3-[3-(2-methoxy-2-oxoethyl)-2-oxo-23-dihydro-13-benzoxazole-6-sulfonamido]benzoate
SMILES
CCOC(c1cccc(NS(c(cc2)cc(O3)c2N(CC(OC)=O)C3=O)(=O)=O)c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
434.43
Hydrogen Bond Acceptors Count
13.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
2.653
Distribution Coefficient, logD
2.650
Water Solubility, LogSw
-3.23
Polar Surface Area
105.321
Acid Dissociation Constant (pKa)
9.61
Base Dissociation Constant (pKb)
-6.24
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
21.10
References: we are preparing a list of scientific research reports with F064-0051 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)