N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,5-difluorophenyl)urea
Chemical Structure Depiction of
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,5-difluorophenyl)urea
N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,5-difluorophenyl)urea
Compound characteristics
| Compound ID: | E002-1308 |
| Compound Name: | N-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N'-(2,5-difluorophenyl)urea |
| Molecular Weight: | 353.39 |
| Molecular Formula: | C15 H17 F2 N5 O S |
| Smiles: | C1CCCN(CC1)c1nnc(NC(Nc2cc(ccc2F)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.4532 |
| logD: | 4.4506 |
| logSw: | -4.1619 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.987 |
| InChI Key: | KBJJPVYPUYPYBF-UHFFFAOYSA-N |