Y050-1773 Screening compound: N-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-4-methoxy-3-methylbenzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound Y050-1773
N-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-4-methoxy-3-methylbenzene-1-sulfonamide
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
Y050-1773
Molecular Formula
C17H27N3O4S (C17 H27 N3 O4 S)
Compound Name
N-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-4-methoxy-3-methylbenzene-1-sulfonamide
IUPAC name
N-[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-4-methoxy-3-methylbenzene-1-sulfonamide
SMILES
CCN(CC1)CCN1C(C(C)NS(c(cc1)cc(C)c1OC)(=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
369.49
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
1.401
Distribution Coefficient, logD
1.145
Water Solubility, LogSw
-2.57
Polar Surface Area
69.460
Acid Dissociation Constant (pKa)
10.87
Base Dissociation Constant (pKb)
7.30
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
58.80
Y050-1773 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Nucleic Acid Ligands (8311 compounds)
Anti-HIV1 Library (19540 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
- Antiviral
- Infections
- Immune system
References: we are preparing a list of scientific research reports with Y050-1773 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)