1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-pyrrole-2-carboxamide
1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | E002-2253 |
| Compound Name: | 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 459.66 |
| Molecular Formula: | C23 H37 N7 O S |
| Smiles: | CCCN1CCN(CCCNC(c2cccn2c2nnc(N3CCCCCC3)s2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.3478 |
| logD: | 2.383 |
| logSw: | -3.4264 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.232 |
| InChI Key: | OVEBYGXTAZVXEQ-UHFFFAOYSA-N |