L553-1421 Screening compound: N-[(4-butoxyphenyl)methyl]-3-[3-methyl-4-(4-methylpiperidin-1-yl)-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of ChemDiv screening compound L553-1421
N-[(4-butoxyphenyl)methyl]-3-[3-methyl-4-(4-methylpiperidin-1-yl)-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propanamide
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
L553-1421
Molecular Formula
C26H35N5O3 (C26 H35 N5 O3)
Compound Name
N-[(4-butoxyphenyl)methyl]-3-[3-methyl-4-(4-methylpiperidin-1-yl)-[1,2]oxazolo[5,4-d]pyrimidin-6-yl]propanamide
IUPAC name
N-[(4-butoxyphenyl)methyl]-3-[3-methyl-4-(4-methylpiperidin-1-yl)-[12]oxazolo[54-d]pyrimidin-6-yl]propanamide
SMILES
CCCCOc1ccc(CNC(CCc2nc(N3CCC(C)CC3)c(c(C)no3)c3n2)=O)cc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
465.6
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.996
Distribution Coefficient, logD
4.994
Water Solubility, LogSw
-4.71
Polar Surface Area
76.982
Acid Dissociation Constant (pKa)
13.88
Base Dissociation Constant (pKb)
5.03
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
53.80
L553-1421 in Drug Discovery
Included in Screening Libraries
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with L553-1421 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)