Basic information
- CAS
139449-83-5- Standard SMILES
Cc1cc(-n2c(C)nc3cc(Cl)ccc3c2=O)on1- InChIKey
SOZNVTIUHYQGON-UHFFFAOYSA-N- Molecular formula
- C13H10ClN3O2
- Average molar mass
- 275.69 g/mol
- Monoisotopic mass
- 275.0461543
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 7-chloro-2-methyl-3-(3-methyl-5-isoxazolyl)-
- IUPAC
- 7-chloro-2-methyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4-one
Names & synonyms
BRN 53821114(3H)-Quinazolinone, 7-chloro-2-methyl-3-(3-methyl-5-isoxazolyl)-139449-83-5DTXSID801610477-Chloro-2-methyl-3-(3-methyl-5-isoxazolyl)-4(3H)-quinazolinoneRefChem:284328DTXCID10835387-chloro-2-methyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4(3h)-one
Database identifiers
- CAS
139449-83-5- PubChem CID
- 64097
- DTXSID
DTXSID80161047- Nikkaji
- J481.107K
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 415
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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