L362-3391 Screening compound: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[2-(1-phenyl-1H-1,3-benzodiazol-2-yl)ethyl]phenyl}urea
Chemical Structure Depiction of ChemDiv screening compound L362-3391
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[2-(1-phenyl-1H-1,3-benzodiazol-2-yl)ethyl]phenyl}urea
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
L362-3391
Molecular Formula
C30H26N4O3 (C30 H26 N4 O3)
Compound Name
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{3-[2-(1-phenyl-1H-1,3-benzodiazol-2-yl)ethyl]phenyl}urea
IUPAC name
3-(23-dihydro-14-benzodioxin-6-yl)-1-{3-[2-(1-phenyl-1H-13-benzodiazol-2-yl)ethyl]phenyl}urea
SMILES
O=C(Nc1cc(CCc2nc(cccc3)c3n2-c2ccccc2)ccc1)Nc(cc1)cc2c1OCCO2
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
490.56
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
5.590
Distribution Coefficient, logD
5.538
Water Solubility, LogSw
-5.81
Polar Surface Area
59.741
Acid Dissociation Constant (pKa)
13.05
Base Dissociation Constant (pKb)
6.50
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
13.30
L362-3391 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
PI3K-Targeted Library (17255 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Kinases
- Epigenetic
References: we are preparing a list of scientific research reports with L362-3391 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)