G869-0798 Screening compound: N-(4-{[4-(diethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-2-ethylbutanamide
Chemical Structure Depiction of ChemDiv screening compound G869-0798
N-(4-{[4-(diethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-2-ethylbutanamide
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
G869-0798
Molecular Formula
C21H31N5O (C21 H31 N5 O)
Compound Name
N-(4-{[4-(diethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-2-ethylbutanamide
IUPAC name
N-(4-{[4-(diethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)-2-ethylbutanamide
SMILES
CCC(CC)C(Nc(cc1)ccc1Nc1nc(N(CC)CC)cc(C)n1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
369.51
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.991
Distribution Coefficient, logD
4.931
Water Solubility, LogSw
-4.60
Polar Surface Area
54.225
Acid Dissociation Constant (pKa)
12.18
Base Dissociation Constant (pKb)
6.57
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
47.60
G869-0798 in Drug Discovery
Included in Screening Libraries
Included in 1.7M Stock Database
- Nervous system
References: we are preparing a list of scientific research reports with G869-0798 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)