Z603-5329 Screening compound: 1-[1-(3-fluorobenzoyl)pyrrolidin-3-yl]-3-methylurea
Chemical Structure Depiction of ChemDiv screening compound Z603-5329
1-[1-(3-fluorobenzoyl)pyrrolidin-3-yl]-3-methylurea
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
Z603-5329
Molecular Formula
C13H16FN3O2 (C13 H16 FN3 O2)
Compound Name
1-[1-(3-fluorobenzoyl)pyrrolidin-3-yl]-3-methylurea
IUPAC name
1-[1-(3-fluorobenzoyl)pyrrolidin-3-yl]-3-methylurea
SMILES
CNC(NC(CC1)CN1C(c1cccc(F)c1)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
265.29
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
0.562
Distribution Coefficient, logD
0.562
Water Solubility, LogSw
-1.96
Polar Surface Area
52.089
Acid Dissociation Constant (pKa)
16.46
Base Dissociation Constant (pKb)
1.50
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
38.50
Z603-5329 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Fragments Library (11262 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
References: we are preparing a list of scientific research reports with Z603-5329 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)