V016-9935 Screening compound: N-{[2-(dimethylamino)-5-(2-phenoxyacetamido)phenyl]methyl}-2-ethyl-N-propylbutanamide
Chemical Structure Depiction of ChemDiv screening compound V016-9935
N-{[2-(dimethylamino)-5-(2-phenoxyacetamido)phenyl]methyl}-2-ethyl-N-propylbutanamide
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
V016-9935
Molecular Formula
C26H37N3O3 (C26 H37 N3 O3)
Compound Name
N-{[2-(dimethylamino)-5-(2-phenoxyacetamido)phenyl]methyl}-2-ethyl-N-propylbutanamide
IUPAC name
N-{[2-(dimethylamino)-5-(2-phenoxyacetamido)phenyl]methyl}-2-ethyl-N-propylbutanamide
SMILES
CCCN(Cc(cc(cc1)NC(COc2ccccc2)=O)c1N(C)C)C(C(CC)CC)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
439.6
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
14.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
5.423
Distribution Coefficient, logD
5.421
Water Solubility, LogSw
-5.31
Polar Surface Area
49.580
Acid Dissociation Constant (pKa)
12.40
Base Dissociation Constant (pKb)
8.21
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
46.20
V016-9935 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with V016-9935 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of V016-9935, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)