G577-0028 Screening compound: ethyl 4-[cyclohexyl(methyl)amino]quinazoline-2-carboxylate
Chemical Structure Depiction of ChemDiv screening compound G577-0028
ethyl 4-[cyclohexyl(methyl)amino]quinazoline-2-carboxylate
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
G577-0028
Molecular Formula
C18H23N3O2 (C18 H23 N3 O2)
Compound Name
ethyl 4-[cyclohexyl(methyl)amino]quinazoline-2-carboxylate
IUPAC name
ethyl 4-[cyclohexyl(methyl)amino]quinazoline-2-carboxylate
SMILES
CCOC(c1nc2ccccc2c(N(C)C2CCCCC2)n1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
313.4
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.249
Distribution Coefficient, logD
4.249
Water Solubility, LogSw
-4.06
Polar Surface Area
41.218
Acid Dissociation Constant (pKa)
20.71
Base Dissociation Constant (pKb)
2.87
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
G577-0028 in Drug Discovery
Included in Screening Libraries
CNS BBB Library (22607 compounds)
SmartTM Library (51161 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with G577-0028 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)