G740-1327 Screening compound: 2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}-N-[2-(4-ethoxyphenyl)ethyl]butanamide
Chemical Structure Depiction of ChemDiv screening compound G740-1327
2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}-N-[2-(4-ethoxyphenyl)ethyl]butanamide
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
G740-1327
Molecular Formula
C27H31N5O3 (C27 H31 N5 O3)
Compound Name
2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}-N-[2-(4-ethoxyphenyl)ethyl]butanamide
IUPAC name
2-{37-dimethyl-4-oxo-2-phenyl-2H4H5H-pyrazolo[34-d]pyridazin-5-yl}-N-[2-(4-ethoxyphenyl)ethyl]butanamide
SMILES
CCC(C(NCCc(cc1)ccc1OCC)=O)N(C(c1c2C)=O)N=C(C)c1nn2-c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
473.58
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.953
Distribution Coefficient, logD
3.953
Water Solubility, LogSw
-4.19
Polar Surface Area
71.110
Acid Dissociation Constant (pKa)
14.23
Base Dissociation Constant (pKb)
0.09
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
33.30
G740-1327 in Drug Discovery
Included in Screening Libraries
Neuropeptide S Library (2850 compounds)
Included in 1.7M Stock Database
- Digestive system
- Nervous system
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with G740-1327 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)