D030-0074 Screening compound: 4-chloro-N-{2-[(2-methoxyphenyl)amino]-2-phenylethyl}benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound D030-0074
4-chloro-N-{2-[(2-methoxyphenyl)amino]-2-phenylethyl}benzene-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
D030-0074
Molecular Formula
C21H21ClN2O3S (C21 H21 ClN2 O3 S)
Compound Name
4-chloro-N-{2-[(2-methoxyphenyl)amino]-2-phenylethyl}benzene-1-sulfonamide
IUPAC name
4-chloro-N-{2-[(2-methoxyphenyl)amino]-2-phenylethyl}benzene-1-sulfonamide
SMILES
COc(cccc1)c1NC(CNS(c(cc1)ccc1Cl)(=O)=O)c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
416.93
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
5.012
Distribution Coefficient, logD
5.012
Water Solubility, LogSw
-5.24
Polar Surface Area
58.794
Acid Dissociation Constant (pKa)
11.24
Base Dissociation Constant (pKb)
1.76
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
14.30
D030-0074 in Drug Discovery
Included in Screening Libraries
Glucocorticoid receptors Library (4806 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Endocrine
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nuclear receptors
- Others
- Proteases
- Receptor's ligands
- Epigenetic
References: we are preparing a list of scientific research reports with D030-0074 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)