Basic information
- CAS
92257-40-4- Standard SMILES
COc1ccc(-c2nc(=O)n(CC3CC3)nc2-c2ccc(OC)cc2)cc1- InChIKey
DMEHEIWCWDNUBJ-UHFFFAOYSA-N- Molecular formula
- C21H21N3O3
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.15829154
Overview
Dizatrifone is a small molecule drug. Dizatrifone has a monoisotopic molecular weight of 363.16 Da.
Names & identifiers
- Preferred name
- Dizatrifone
- IUPAC
- 2-(cyclopropylmethyl)-5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-one
- English name
- Dizatrifone
- Molecular formula
- C21H21N3O3
- Molecular weight
- 363.41
Names & synonyms
DizatrifoneDizatrifona92257-40-4Dizatrifonum913423W85VDTXSID10238938RefChem:135281DTXCID601614295,6-bis(4-methoxyphenyl)-2-cyclopropylmethyl-1,2,4-triazin-3-oneDizatrifone [INN]2-(cyclopropylmethyl)-5,6-bis(4-methoxyphenyl)-1,2,4-triazin-3-one2-(Cyclopropylmethyl)-5,6-bis(p-methoxyphenyl)-as-triazin-3(2H)-one
Show more names
2-(Cyclopropylmethyl)-5,6-bis(p-methoxyphenyl)-1,2,4-triazin-3(2H)-one1,2,4-Triazin-3(2H)-one, 2-(cyclopropylmethyl)-5,6-bis(4-methoxyphenyl)-
Dizatrifonum [Latin]Dizatrifona [Spanish]UNII-913423W85Vorb1741140SCHEMBL2107747CHEMBL2104279NS00121054T68340
Database identifiers
- CAS
92257-40-4- PubChem CID
- 65830
- DTXSID
DTXSID10238938- ChEMBL
CHEMBL2104279- UNII
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 598
Physicochemical properties
- FDA UNII
- 913423 W85V · 913423W85V
Chemistry & industry
Suppliers2 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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