V012-2983 Screening compound: N-[(4-fluorophenyl)methyl]-2-[1-(4-methyl-3-nitrophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound V012-2983
N-[(4-fluorophenyl)methyl]-2-[1-(4-methyl-3-nitrophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide
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
V012-2983
Molecular Formula
C29H33FN4O5S (C29 H33 FN4 O5 S)
Compound Name
N-[(4-fluorophenyl)methyl]-2-[1-(4-methyl-3-nitrophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide
IUPAC name
N-[(4-fluorophenyl)methyl]-2-[1-(4-methyl-3-nitrophenyl)-N-[2-(morpholin-4-yl)ethyl]formamido]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILES
Cc1c(CN(Cc(cc2)ccc2F)C(CN(CCN2CCOCC2)C(c2cc([N+]([O-])=O)c(C)cc2)=O)=O)scc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
568.67
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
3.652
Distribution Coefficient, logD
3.647
Water Solubility, LogSw
-3.96
Polar Surface Area
77.830
Acid Dissociation Constant (pKa)
21.89
Base Dissociation Constant (pKb)
5.43
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
37.90
References: we are preparing a list of scientific research reports with V012-2983 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)