Y070-0905 Screening compound: (2E)-N-butyl-2-[(4-chlorophenyl)formamido]-3-(3-phenoxyphenyl)prop-2-enamide
Chemical Structure Depiction of ChemDiv screening compound Y070-0905
(2E)-N-butyl-2-[(4-chlorophenyl)formamido]-3-(3-phenoxyphenyl)prop-2-enamide
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
Y070-0905
Molecular Formula
C26H25ClN2O3 (C26 H25 ClN2 O3)
Compound Name
(2E)-N-butyl-2-[(4-chlorophenyl)formamido]-3-(3-phenoxyphenyl)prop-2-enamide
IUPAC name
(2E)-N-butyl-2-[(4-chlorophenyl)formamido]-3-(3-phenoxyphenyl)prop-2-enamide
SMILES
CCCCNC(/C(/NC(c(cc1)ccc1Cl)=O)=C\c1cc(Oc2ccccc2)ccc1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
448.95
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
11.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.934
Distribution Coefficient, logD
4.285
Water Solubility, LogSw
-6.18
Polar Surface Area
53.437
Acid Dissociation Constant (pKa)
5.76
Base Dissociation Constant (pKb)
4.14
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.40
Y070-0905 in Drug Discovery
Included in Screening Libraries
MCL1 Targeted Library (12200 compounds)
?ysteine Targeted Covalent Library (39471 compounds)
Included in 1.7M Stock Database
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
References: we are preparing a list of scientific research reports with Y070-0905 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)