5504-0193 Screening compound: 2,2-dimethyl-5-morpholino-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl hexyl sulfide
Chemical Structure Depiction of ChemDiv screening compound 5504-0193
2,2-dimethyl-5-morpholino-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl hexyl sulfide
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
5504-0193
Molecular Formula
C24H32N4O2S2 (C24 H32 N4 O2 S2)
Compound Name
2,2-dimethyl-5-morpholino-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl hexyl sulfide
IUPAC name
13-(hexylsulfanyl)-44-dimethyl-8-(morpholin-4-yl)-5-oxa-11-thia-91416-triazatetracyclo[8.7.0.0^{27}.0^{1217}]heptadeca-1(10)2(7)812(17)1315-hexaene
SMILES
CCCCCCSc1c2sc3nc(N4CCOCC4)c(COC(C)(C)C4)c4c3c2ncn1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
472.68
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
6.938
Distribution Coefficient, logD
6.937
Water Solubility, LogSw
-6.10
Polar Surface Area
49.297
Acid Dissociation Constant (pKa)
22.06
Base Dissociation Constant (pKb)
4.11
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
62.50
5504-0193 in Drug Discovery
Included in Screening Libraries
Dark Chemical Matter Library (18430 compounds)
Akt-Targeted Library (14764 compounds)
Included in 1.7M Stock Database
- Pool
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with 5504-0193 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of 5504-0193, 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)