M503-1488 Screening compound: 4-amino-N-[(2-fluorophenyl)methyl]-2-[4-(propan-2-yl)piperazin-1-yl]pyrimidine-5-carboxamide
Chemical Structure Depiction of ChemDiv screening compound M503-1488
4-amino-N-[(2-fluorophenyl)methyl]-2-[4-(propan-2-yl)piperazin-1-yl]pyrimidine-5-carboxamide
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
M503-1488
Molecular Formula
C19H25FN6O (C19 H25 FN6 O)
Compound Name
4-amino-N-[(2-fluorophenyl)methyl]-2-[4-(propan-2-yl)piperazin-1-yl]pyrimidine-5-carboxamide
IUPAC name
4-amino-N-[(2-fluorophenyl)methyl]-2-[4-(propan-2-yl)piperazin-1-yl]pyrimidine-5-carboxamide
SMILES
CC(C)N(CC1)CCN1c(nc1)nc(N)c1C(NCc(cccc1)c1F)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
372.45
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.158
Distribution Coefficient, logD
1.159
Water Solubility, LogSw
-2.77
Polar Surface Area
70.685
Acid Dissociation Constant (pKa)
11.61
Base Dissociation Constant (pKb)
8.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
42.10
M503-1488 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
C-Met Library (15277 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Hemic and lymphatic
- Cardiovascular
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Kinases
- Phosphatases
- Receptor's ligands
References: we are preparing a list of scientific research reports with M503-1488 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)