Chemical identity
8-[2-benzhydryloxyethyl(dimethyl)azaniumyl]-1,3-dimethyl-2-oxopurin-6-olate
CAS 64487-94-1 · C24H27N5O3
01Identity
Identifiers and names for this exact compound. Empty fields are left unassigned.
| Lazychem ID | LC-13021 |
|---|---|
| PubChem CID | 5256129 |
| Name | 8-[2-benzhydryloxyethyl(dimethyl)azaniumyl]-1,3-dimethyl-2-oxopurin-6-olate |
| CAS RN | 64487-94-1 |
| Molecular formula | C24H27N5O3 |
| Molecular weight | 433.51 g/mol |
| IUPAC name | 8-((2-(benzhydryloxy)ethyl)dimethylammonio)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-ide |
| InChIKey | NDLAELDZJPCANE-UHFFFAOYSA-N |
02Structure identifiers
![2D structure: 8-[2-benzhydryloxyethyl(dimethyl)azaniumyl]-1,3-dimethyl-2-oxopurin-6-olate, CAS 64487-94-1](/structures/pubchem/5256129/64487-94-1-8-2-benzhydryloxyethyl-dimethyl-azaniumyl-1-3-dimethyl-2-oxopurin-6-olate-2d-structure-900.png)
Structure facts for this exact identity.
| Molecular formula | C24H27N5O3 |
|---|---|
| InChIKey | NDLAELDZJPCANE-UHFFFAOYSA-N |
| Ring count | 4 |
| Defined stereocentres | 0 |
| Unassigned stereocentres | 0 |
| SMILES | O=C1N(C)C(N(C)C2=C1[N-]C([N+](C)(CCOC(C3=CC=CC=C3)C4=CC=CC=C4)C)=N2)=O |
|---|---|
| InChI | InChI=1S/C24H27N5O3/c1-27-21-19(22(30)28(2)24(27)31)25-23(26-21)29(3,4)15-16-32-20(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,20H,15-16H2,1-4H3 |
03India status for this compound
These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.
| NDPS / RCS | NOT FOUND IN REVIEWED ENTRIES | CAS 64487-94-1 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated. |
|---|---|---|
| SCOMET | NOT FOUND IN REVIEWED CAS ENTRIES | CAS 64487-94-1 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated. |
- Narcotic Drugs and Psychotropic Substances Act, 1985, ScheduleDepartment of Revenue, Government of India · source version 1985-09-16
- Controlled-substances notifications and amendmentsDepartment of Revenue, Government of India · source version 2026-03-11
- Appendix 3, SCOMET ListDirectorate General of Foreign Trade, Government of India · source version 2024-09-02
04Names and relationships
Associated parent compound
Dimenhydrinate
View API and impurity familyOther names
- Dimenhydrinate Impurity 1
05Documented history
Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.
No verified discovery, first report, occurrence, use or issue event is currently available for this identity.
06Sources
- S01PubChem compound record, CID 5256129
Names and machine-readable chemical identity properties.
- S02NCBI website and molecular data policies
Reuse policy for NCBI molecular data. This page does not reproduce vendor descriptions or contributed narrative text.
- S03Narcotic Drugs and Psychotropic Substances Act, 1985, Schedule
Department of Revenue, Government of India. Used for the exact-compound India status shown on this page.
- S04Controlled-substances notifications and amendments
Department of Revenue, Government of India. Used for the exact-compound India status shown on this page.
- S05Appendix 3, SCOMET List
Directorate General of Foreign Trade, Government of India. Used for the exact-compound India status shown on this page.