V027-5802 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(1-methyl-4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanamide
Chemical Structure Depiction of ChemDiv screening compound V027-5802
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(1-methyl-4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanamide
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
V027-5802
Molecular Formula
C30H33N3O3S (C30 H33 N3 O3 S)
Compound Name
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(1-methyl-4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]butanamide
IUPAC name
N-[2-(34-dimethoxyphenyl)ethyl]-4-[(1-methyl-45-diphenyl-1H-imidazol-2-yl)sulfanyl]butanamide
SMILES
Cn1c(SCCCC(NCCc(cc2)cc(OC)c2OC)=O)nc(-c2ccccc2)c1-c1ccccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
not_available
Molecular Weight
515.68
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.248
Distribution Coefficient, logD
4.247
Water Solubility, LogSw
-4.30
Polar Surface Area
50.900
Acid Dissociation Constant (pKa)
14.38
Base Dissociation Constant (pKb)
4.97
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
26.70
V027-5802 in Drug Discovery
Included in Screening Libraries
Antimitotic Tubulin Library (17355 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
References: we are preparing a list of scientific research reports with V027-5802 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)