V030-8104 Screening compound: 3-(3-ethylphenyl)-1-[(2-fluorophenyl)methyl]-1-{[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Chemical Structure Depiction of ChemDiv screening compound V030-8104
3-(3-ethylphenyl)-1-[(2-fluorophenyl)methyl]-1-{[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
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
V030-8104
Molecular Formula
C27H28FN3O3 (C27 H28 FN3 O3)
Compound Name
3-(3-ethylphenyl)-1-[(2-fluorophenyl)methyl]-1-{[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
IUPAC name
3-(3-ethylphenyl)-1-[(2-fluorophenyl)methyl]-1-{[3-(2-methoxyphenyl)-45-dihydro-12-oxazol-5-yl]methyl}urea
SMILES
CCc1cccc(NC(N(CC(C2)ON=C2c(cccc2)c2OC)Cc(cccc2)c2F)=O)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
461.54
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.829
Distribution Coefficient, logD
5.829
Water Solubility, LogSw
-5.56
Polar Surface Area
55.465
Acid Dissociation Constant (pKa)
14.63
Base Dissociation Constant (pKb)
0.94
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
25.90
References: we are preparing a list of scientific research reports with V030-8104 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)