4(3H)-Quinazolinone, 3-(2,5-dichlorophenyl)-2-methyl-
Basic information
- CAS
54681-83-3- Standard SMILES
Cc1nc2ccccc2c(=O)n1-c1cc(Cl)ccc1Cl- InChIKey
XCDGNQCQHRLLAF-UHFFFAOYSA-N- Molecular formula
- C15H10Cl2N2O
- Average molar mass
- 305.2 g/mol
- Monoisotopic mass
- 304.0170183
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(2,5-dichlorophenyl)-2-methyl-
- IUPAC
- 3-(2,5-dichlorophenyl)-2-methylquinazolin-4-one
Names & synonyms
54681-83-34(3H)-Quinazolinone, 3-(2,5-dichlorophenyl)-2-methyl-3-(2,5-Dichlorophenyl)-2-methyl-4(3H)-quinazolinoneDTXSID50203140RefChem:283967DTXCID501256313-(2,5-dichlorophenyl)-2-methylquinazolin-4-one3-(2,5-dichlorophenyl)-2-methylquinazolin-4(3H)-oneZINC315921Cambridge id 7136489MFCD01759653STK071683
Show more names
ZINC00315921AKOS000663240ZINC000000315921Clc1ccc(c(c1)n1c(C)nc2c(c1=O)cccc2)ClST451221403(25DICHLOROPHENYL)2METHYLQUINAZOLIN4ONE3(25DICHLOROPHENYL)2METHYL3HQUINAZOLIN4ONE3(25DICHLOROPHENYL)2METHYL3HYDROQUINAZOLIN4ONE
Database identifiers
- CAS
54681-83-3- PubChem CID
- 63791
- DTXSID
DTXSID50203140
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 426
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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