4(3H)-Quinazolinone, 3-(2,4-dichlorophenyl)-2-methyl-
Basic information
- CAS
4285-65-8- Standard SMILES
Cc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1Cl- InChIKey
GCFCLPQARRCRAG-UHFFFAOYSA-N- Molecular formula
- C15H10Cl2N2O
- Average molar mass
- 305.2 g/mol
- Monoisotopic mass
- 304.0170183
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(2,4-dichlorophenyl)-2-methyl-
- IUPAC
- 3-(2,4-dichlorophenyl)-2-methylquinazolin-4-one
Names & synonyms
4285-65-83-(2,4-Dichlorophenyl)-2-methyl-4(3H)-quinazolinoneBRN 08902494(3H)-Quinazolinone, 3-(2,4-dichlorophenyl)-2-methyl-DTXSID901955355-24-03-00131 (Beilstein Handbook Reference)RefChem:283960DTXCID301180263-(2,4-dichlorophenyl)-2-methylquinazolin-4-one3-(2,4-dichlorophenyl)-2-methylquinazolin-4(3H)-oneOprea1_325906Oprea1_849084
Show more names
MLS0012125603-(2,4-Dichloro-phenyl)-2-methyl-3H-quinazolin-4-oneCHEMBL1708703SCHEMBL11699510HMS2845B06STK042546AKOS000540993NCGC00244996-01
Database identifiers
- CAS
4285-65-8- PubChem CID
- 63203
- DTXSID
DTXSID90195535- ChEMBL
CHEMBL1708703
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
Experimental & physicochemical properties
Solubility>45.8 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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