3-{[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylquinazolin-4(3H)-one
Chemical Structure Depiction of
3-{[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylquinazolin-4(3H)-one
3-{[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylquinazolin-4(3H)-one
Compound characteristics
Compound ID: | F387-0079 |
Compound Name: | 3-{[5-(2-bromophenyl)-1,2,4-oxadiazol-3-yl]methyl}-2-methylquinazolin-4(3H)-one |
Molecular Weight: | 397.23 |
Molecular Formula: | C18 H13 Br N4 O2 |
Smiles: | CC1=Nc2ccccc2C(N1Cc1nc(c2ccccc2[Br])on1)=O |
Stereo: | ACHIRAL |
logP: | 2.8468 |
logD: | 2.8468 |
logSw: | -3.448 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 57.053 |
InChI Key: | MOCGNXZQHOSBBP-UHFFFAOYSA-N |