C700-1771 Screening compound: ethyl 3-[({[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]propanoate
Chemical Structure Depiction of ChemDiv screening compound C700-1771
ethyl 3-[({[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]propanoate
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
C700-1771
Molecular Formula
C19H24FN3O3 (C19 H24 FN3 O3)
Compound Name
ethyl 3-[({[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]propanoate
IUPAC name
ethyl 3-[({[1-(4-fluorophenyl)-25-dimethyl-1H-pyrrol-3-yl]methyl}carbamoyl)amino]propanoate
SMILES
CCOC(CCNC(NCc(cc1C)c(C)n1-c(cc1)ccc1F)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
361.42
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.081
Distribution Coefficient, logD
2.081
Water Solubility, LogSw
-2.83
Polar Surface Area
58.122
Acid Dissociation Constant (pKa)
14.05
Base Dissociation Constant (pKb)
-0.34
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
36.80
References: we are preparing a list of scientific research reports with C700-1771 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)