0927-0176 Screening compound: 4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-6-bromobenzene-1,3-diol
Chemical Structure Depiction of ChemDiv screening compound 0927-0176
4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-6-bromobenzene-1,3-diol
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
0927-0176
Molecular Formula
C18H22BrN7O4 (C18 H22 BrN7 O4)
Compound Name
4-[(E)-{2-[4,6-bis(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazin-1-ylidene}methyl]-6-bromobenzene-1,3-diol
IUPAC name
4-[(E)-{2-[46-bis(morpholin-4-yl)-135-triazin-2-yl]hydrazin-1-ylidene}methyl]-6-bromobenzene-13-diol
SMILES
Oc(c(/C=N/Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1)c1)cc(O)c1Br
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
480.32
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
11
Partition Coefficient, logP
3.531
Distribution Coefficient, logD
3.481
Water Solubility, LogSw
-3.24
Polar Surface Area
106.048
Acid Dissociation Constant (pKa)
8.41
Base Dissociation Constant (pKb)
7.22
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
44.40
0927-0176 in Drug Discovery
Included in Screening Libraries
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Agro
References: we are preparing a list of scientific research reports with 0927-0176 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)