6-chloro-4-({3-[(4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-({3-[(4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-({3-[(4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F387-0995 |
| Compound Name: | 6-chloro-4-({3-[(4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazol-5-yl}methyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 423.81 |
| Molecular Formula: | C20 H14 Cl N5 O4 |
| Smiles: | C(c1nc(CN2C(COc3ccc(cc23)[Cl])=O)on1)N1C=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.6409 |
| logD: | 1.6409 |
| logSw: | -2.8451 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.774 |
| InChI Key: | QBWBVSZYBSIETO-UHFFFAOYSA-N |