4119-0088 Screening compound: morpholino(10-morpholino-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)methanone
Chemical Structure Depiction of ChemDiv screening compound 4119-0088
morpholino(10-morpholino-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)methanone
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
4119-0088
Molecular Formula
C23H27N3O3 (C23 H27 N3 O3)
Compound Name
morpholino(10-morpholino-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)methanone
IUPAC name
9-(morpholin-4-yl)-2-(morpholine-4-carbonyl)-2-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaene
SMILES
O=C(N1CCOCC1)N(c1c(CC2N3CCOCC3)cccc1)c1c2cccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
393.49
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.678
Distribution Coefficient, logD
2.588
Water Solubility, LogSw
-2.88
Polar Surface Area
34.382
Acid Dissociation Constant (pKa)
24.67
Base Dissociation Constant (pKb)
6.76
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
43.50
4119-0088 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Anti-Aging Library (44940 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
CNS BBB Library (22607 compounds)
DGK Inhibitors Library (10558 compounds)
Dark Chemical Matter Library (18430 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Regenerative Medicine Focused Library (23016 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Ion Channels Focused Library (26372 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Nervous system
- Cancer
- Digestive system
- Hemic and lymphatic
- Skin
- Metabolic
- Immune system
- Musculoskeletal
- Digestive system
- Hemic and lymphatic
- Cardiovascular
- Skin
- wounds
- Nervous system
- Cardiovascular
- Epigenetic
- Kinases
- Ion Channels
References: we are preparing a list of scientific research reports with 4119-0088 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of 4119-0088, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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)