1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione
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Basic information
- CAS
1632-29-7- Standard SMILES
Cn1nnc2c1c(=O)[nH]c(=O)n2C- InChIKey
UFLYXBDGSAGNAR-UHFFFAOYSA-N- Molecular formula
- C6H7N5O2
- Average molar mass
- 181.15 g/mol
- Monoisotopic mass
- 181.05997448
Names & identifiers
- Preferred name
- 1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione
- IUPAC
- 1,4-dimethyltriazolo[4,5-d]pyrimidine-5,7-dione
- English name
- 1,4-Dimethyl-1H-1,2,3-triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
- Molecular formula
- C6H7N5O2
- Molecular weight
- 181.15
Names & synonyms
1632-29-7C20V6CWK8F1H-v-Triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione, 1,4-dimethyl-NSC-94212DTXSID201675281,4-Dimethyl-1H-1,2,3-triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione1H-1,2,3-Triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione, 1,4-dimethyl-1,4-Dimethyl-1H-1,2,3-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dioneRefChem:1053292DTXCID80900193,7-Dimethyl-8-azaxanthin1,4-dimethyl-1h-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4h,6h)-dione
Show more names
1,4-Dimethyl-1H-v-triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione1H-1,2,3-Triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione, 1,4-dimethyl-
1,4-dimethyltriazolo[4,5-d]pyrimidine-5,7-dioneNSC 94212BRN 05294113,7-dimethyl-8-azaxanthineNSC942121,4-Dimethyl-1H-s-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione1,4-Dimethyl-1H-v-triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione1H-s-Triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione, 1,4-dimethyl-
Database identifiers
- CAS
1632-29-7- PubChem CID
- 96930
- DTXSID
DTXSID20167528- UNII
- C20V6CWK8F
- Nikkaji
- J40.775E
Properties
Computed structural propertiesFilling in
- XLogP
- -0.9
- Topological polar surface area
- 80.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 268
Physicochemical properties
- FDA UNII
- 20 V6CWK8F · C20V6CWK8F
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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