V009-5073 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[1-(4-nitrophenyl)-N-(propan-2-yl)formamido]acetamide
Chemical Structure Depiction of ChemDiv screening compound V009-5073
N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[1-(4-nitrophenyl)-N-(propan-2-yl)formamido]acetamide
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
V009-5073
Molecular Formula
C31H34N4O6 (C31 H34 N4 O6)
Compound Name
N-[(3,4-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[1-(4-nitrophenyl)-N-(propan-2-yl)formamido]acetamide
IUPAC name
N-[(34-dimethoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[1-(4-nitrophenyl)-N-(propan-2-yl)formamido]acetamide
SMILES
CC(C)N(CC(N(CCc1c[nH]c2c1cccc2)Cc(cc1)cc(OC)c1OC)=O)C(c(cc1)ccc1[N+]([O-])=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
558.63
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
14.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
4.269
Distribution Coefficient, logD
4.269
Water Solubility, LogSw
-4.23
Polar Surface Area
90.368
Acid Dissociation Constant (pKa)
18.49
Base Dissociation Constant (pKb)
1.06
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
29.00
V009-5073 in Drug Discovery
Included in Screening Libraries
Indole Derivatives (10091 compounds)
Included in 1.7M Stock Database
- Cyclic compounds
References: we are preparing a list of scientific research reports with V009-5073 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)