G072-1201 Screening compound: N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-2-methylpropanamide
Chemical Structure Depiction of ChemDiv screening compound G072-1201
N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-2-methylpropanamide
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
G072-1201
Molecular Formula
C20H24N4O2S2 (C20 H24 N4 O2 S2)
Compound Name
N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-2-methylpropanamide
IUPAC name
N-{2-[({2-butyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-2-methylpropanamide
SMILES
CCCCC(SC1=NC(CSc(cccc2)c2NC(C(C)C)=O)=C2)=NN1C2=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
416.57
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.300
Distribution Coefficient, logD
4.300
Water Solubility, LogSw
-4.11
Polar Surface Area
60.839
Acid Dissociation Constant (pKa)
12.18
Base Dissociation Constant (pKb)
4.40
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
References: we are preparing a list of scientific research reports with G072-1201 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)