N-[2-(azepan-1-yl)ethyl]-3-[(2-methyl-4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-3-[(2-methyl-4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(azepan-1-yl)ethyl]-3-[(2-methyl-4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F387-1583 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-3-[(2-methyl-4-oxoquinazolin-3(4H)-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C21 H26 N6 O3 |
| Smiles: | CC1=Nc2ccccc2C(N1Cc1nc(C(NCCN2CCCCCC2)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3498 |
| logD: | -0.2482 |
| logSw: | -2.3938 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.893 |
| InChI Key: | XOBUKUTVFYGSRB-UHFFFAOYSA-N |