C200-4812 Screening compound: {3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
Chemical Structure Depiction of ChemDiv screening compound C200-4812
{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
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
C200-4812
Molecular Formula
C22H19N3O6 (C22 H19 N3 O6)
Compound Name
{3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-8-methyl-2-oxo-2H-pyrano[2,3-c]pyridin-5-yl}methyl propanoate
IUPAC name
{3-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-8-methyl-2-oxo-2H-pyrano[23-c]pyridin-5-yl}methyl propanoate
SMILES
CCC(OCc1cnc(C)c(O2)c1C=C(c1nc(-c(cc3)ccc3OC)no1)C2=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
421.41
Hydrogen Bond Acceptors Count
11.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.733
Distribution Coefficient, logD
3.733
Water Solubility, LogSw
-4.16
Polar Surface Area
90.042
Acid Dissociation Constant (pKa)
23.13
Base Dissociation Constant (pKb)
-2.48
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
22.70
C200-4812 in Drug Discovery
Included in Screening Libraries
Antifungal Library (16415 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Agro
References: we are preparing a list of scientific research reports with C200-4812 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)