Research chemical
CAS Number: 4818-23-9
![11-morpholino-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione molecular structure, CAS 4818-23-9](/structure-images/4818-23-9.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
1388580
Exact Mass
398.098352
InChIKey
IVMMMABAEZFXNC-UHFFFAOYSA-N
IUPAC Name
14-morpholin-4-yl-11-thia-3,5,7,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,8,13,15(20)-hexaene-6-thione
SMILES String
Sc1nnc2c3sc4nc(N5CCOCC5)c5c(c4c3ncn12)CCCC5
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
11-morpholino-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione is identified by CAS 4818-23-9, with molecular formula C18H18N6OS2, molecular weight 398.5, InChIKey IVMMMABAEZFXNC-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
Heavy atom count
27
H-bond acceptors
7
H-bond donors
0
Rotatable bonds
1
Ring count
6
Aromatic rings
4
Topological polar surface area
68.44 Ų
Computed LogP
2.89
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
11-morpholino-7,8,9,10-tetrahydro-[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline-3(2H)-thione (CAS 4818-23-9) is maintained as a commercial cas reference with formula C18H18N6OS2, molecular weight 398. 50 g/mol, PubChem CID 1388580.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include nitrogen-containing heterocycle, drug-like rule profile.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.