N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(4-bromophenyl)urea
Chemical Structure Depiction of
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(4-bromophenyl)urea
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(4-bromophenyl)urea
Compound characteristics
| Compound ID: | E002-1310 |
| Compound Name: | N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(4-bromophenyl)urea |
| Molecular Weight: | 396.31 |
| Molecular Formula: | C15 H18 Br N5 O S |
| Smiles: | C1CCCN(CC1)c1nnc(NC(Nc2ccc(cc2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.1188 |
| logD: | 5.1188 |
| logSw: | -5.0979 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.685 |
| InChI Key: | RKOUSMYMULOZSG-UHFFFAOYSA-N |