2-(azepan-1-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(azepan-1-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
2-(azepan-1-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0620 |
| Compound Name: | 2-(azepan-1-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 419.55 |
| Molecular Formula: | C19 H29 N7 O2 S |
| Smiles: | CN1CCN(CCNC(C2=CC(N=C3N2N=C(N2CCCCCC2)S3)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 0.7297 |
| logD: | -0.0042 |
| logSw: | -1.6992 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.058 |
| InChI Key: | UQDJELNESXXUJA-UHFFFAOYSA-N |