Y600-4392 Screening compound: 3,11-di(2-furyl)-10-(4-methoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of ChemDiv screening compound Y600-4392
3,11-di(2-furyl)-10-(4-methoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
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
Y600-4392
Molecular Formula
C29H24N2O5 (C29 H24 N2 O5)
Compound Name
3,11-di(2-furyl)-10-(4-methoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
IUPAC name
1014-bis(furan-2-yl)-9-(4-methoxybenzoyl)-29-diazatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)46-tetraen-12-one
SMILES
COc(cc1)ccc1C(N(C1c2ccco2)c(cccc2)c2NC(CC(C2)c3ccco3)=C1C2=O)=O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
480.52
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.973
Distribution Coefficient, logD
4.922
Water Solubility, LogSw
-4.56
Polar Surface Area
63.594
Acid Dissociation Constant (pKa)
8.30
Base Dissociation Constant (pKb)
-2.36
Number of Chiral Centers
2.00
Percent sp3 carbon bonding
17.24
Y600-4392 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with Y600-4392 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of Y600-4392, 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)