Basic information
- CAS
7464-12-2- Standard SMILES
Cc1nc2c(=O)[nH][nH]c(=O)c2s1- InChIKey
AFUIGSKTJVHHHJ-UHFFFAOYSA-N- Molecular formula
- C6H5N3O2S
- Average molar mass
- 183.19 g/mol
- Monoisotopic mass
- 183.01024758
Names & identifiers
- Preferred name
- 2-Methyl-5,6-dihydro[1,3]thiazolo[4,5-d]pyridazine-4,7-dione
- IUPAC
- 2-methyl-5,6-dihydro-[1,3]thiazolo[4,5-d]pyridazine-4,7-dione
Names & synonyms
7464-12-2NSC4033662-methyl-5,6-dihydro[1,3]thiazolo[4,5-d]pyridazine-4,7-dioneAP-786/422999572-methyl-5,6-dihydro-[1,3]thiazolo[4,5-d]pyridazine-4,7-dioneSCHEMBL4403090DTXSID10323212NSC-4033662-methyl-5,6-dihydrothiazolo[4,5-d]pyridazine-4,7-dioneThiazolo[4,5-d]pyridazine-4,7-dione, 5,6-dihydro-2-methyl-
Database identifiers
- CAS
7464-12-2- PubChem CID
- 345640
- DTXSID
DTXSID10323212
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 99.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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